KRE
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C29 | N30 | sing | 1.47Å | 1.42Å | |
C29 | C28 | sing | 1.53Å | 1.53Å | |
N30 | C31 | sing | 1.47Å | 1.41Å | |
C28 | N27 | sing | 1.47Å | 1.49Å | |
C31 | C32 | sing | 1.53Å | 1.53Å | |
N27 | C32 | sing | 1.47Å | 1.49Å | |
N27 | C26 | sing | 1.40Å | 1.47Å | |
C25 | C26 | doub | 1.39Å | 1.40Å | Aromatic |
C25 | C24 | sing | 1.38Å | 1.39Å | Aromatic |
C26 | C23 | sing | 1.39Å | 1.38Å | Aromatic |
C24 | C21 | doub | 1.39Å | 1.38Å | Aromatic |
C23 | C22 | doub | 1.38Å | 1.39Å | Aromatic |
C21 | C22 | sing | 1.39Å | 1.39Å | Aromatic |
C21 | C20 | sing | 1.48Å | 1.53Å | |
C19 | C20 | doub | 1.39Å | 1.39Å | Aromatic |
C19 | N18 | sing | 1.32Å | 1.32Å | Aromatic |
C20 | C17 | sing | 1.40Å | 1.39Å | Aromatic |
N18 | C02 | doub | 1.32Å | 1.31Å | Aromatic |
C17 | C03 | doub | 1.39Å | 1.38Å | Aromatic |
C02 | C03 | sing | 1.40Å | 1.38Å | Aromatic |
C02 | N01 | sing | 1.39Å | 1.45Å | |
C03 | C04 | sing | 1.48Å | 1.54Å | |
C04 | C16 | doub | 1.39Å | 1.40Å | Aromatic |
C04 | C05 | sing | 1.39Å | 1.38Å | Aromatic |
C16 | C13 | sing | 1.39Å | 1.39Å | Aromatic |
C05 | C06 | doub | 1.39Å | 1.39Å | Aromatic |
C13 | O14 | sing | 1.36Å | 1.41Å | |
C13 | C12 | doub | 1.39Å | 1.40Å | Aromatic |
C06 | C12 | sing | 1.39Å | 1.40Å | Aromatic |
C06 | N07 | sing | 1.40Å | 1.45Å | |
O14 | C15 | sing | 1.43Å | 1.40Å | |
C10 | S08 | sing | 1.81Å | 1.81Å | |
O09 | S08 | doub | 1.42Å | 1.47Å | |
N07 | S08 | sing | 1.66Å | 1.69Å | |
S08 | O11 | doub | 1.42Å | 1.46Å | |
C15 | H153 | sing | 1.09Å | 1.10Å | |
C15 | H151 | sing | 1.09Å | 1.10Å | |
C15 | H152 | sing | 1.09Å | 1.10Å | |
C19 | H191 | sing | 1.08Å | 1.08Å | |
C12 | H121 | sing | 1.08Å | 1.08Å | |
C16 | H161 | sing | 1.08Å | 1.08Å | |
C17 | H171 | sing | 1.08Å | 1.08Å | |
C05 | H051 | sing | 1.08Å | 1.08Å | |
C10 | H101 | sing | 1.09Å | 1.10Å | |
C10 | H103 | sing | 1.09Å | 1.10Å | |
C10 | H102 | sing | 1.09Å | 1.10Å | |
C22 | H221 | sing | 1.08Å | 1.08Å | |
C23 | H231 | sing | 1.08Å | 1.08Å | |
C24 | H241 | sing | 1.08Å | 1.08Å | |
C25 | H251 | sing | 1.08Å | 1.08Å | |
C28 | H282 | sing | 1.09Å | 1.10Å | |
C28 | H281 | sing | 1.09Å | 1.10Å | |
C29 | H291 | sing | 1.09Å | 1.10Å | |
C29 | H292 | sing | 1.09Å | 1.10Å | |
C31 | H311 | sing | 1.09Å | 1.10Å | |
C31 | H312 | sing | 1.09Å | 1.10Å | |
C32 | H322 | sing | 1.09Å | 1.10Å | |
C32 | H321 | sing | 1.09Å | 1.10Å | |
N01 | H011 | sing | 0.97Å | 1.00Å | |
N01 | H012 | sing | 0.97Å | 1.00Å | |
N07 | H071 | sing | 0.97Å | 1.00Å | |
N30 | H301 | sing | 1.01Å | 1.00Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
N30 | C29 | C28 | 112.7° | 109.3° |
C29 | N30 | C31 | 113.3° | 110.9° |
N30 | C29 | H291 | 108.7° | 109.5° |
N30 | C29 | H292 | 108.7° | 109.5° |
C29 | N30 | H301 | 108.5° | 111.0° |
C29 | C28 | N27 | 111.1° | 109.4° |
C29 | C28 | H282 | 109.0° | 109.5° |
C29 | C28 | H281 | 109.1° | 109.5° |
C28 | C29 | H291 | 108.7° | 109.5° |
C28 | C29 | H292 | 108.7° | 109.5° |
N30 | C31 | C32 | 112.4° | 109.4° |
N30 | C31 | H311 | 108.7° | 109.5° |
N30 | C31 | H312 | 108.7° | 109.5° |
C31 | N30 | H301 | 108.5° | 111.0° |
C28 | N27 | C32 | 107.8° | 110.8° |
C28 | N27 | C26 | 121.5° | 111.0° |
N27 | C28 | H282 | 109.1° | 109.5° |
N27 | C28 | H281 | 109.0° | 109.5° |
C31 | C32 | N27 | 112.1° | 109.4° |
C32 | C31 | H311 | 108.7° | 109.5° |
C32 | C31 | H312 | 108.8° | 109.5° |
C31 | C32 | H322 | 108.8° | 109.5° |
C31 | C32 | H321 | 108.8° | 109.5° |
C32 | N27 | C26 | 120.0° | 111.0° |
N27 | C32 | H322 | 108.8° | 109.4° |
N27 | C32 | H321 | 108.8° | 109.5° |
N27 | C26 | C25 | 120.7° | 120.0° |
N27 | C26 | C23 | 118.9° | 120.0° |
C26 | C25 | C24 | 119.8° | 120.1° |
C25 | C26 | C23 | 120.4° | 120.0° |
C26 | C25 | H251 | 120.1° | 119.9° |
C25 | C24 | C21 | 119.7° | 120.0° |
C25 | C24 | H241 | 120.2° | 120.0° |
C24 | C25 | H251 | 120.1° | 120.0° |
C26 | C23 | C22 | 119.5° | 120.1° |
C26 | C23 | H231 | 120.2° | 119.9° |
C24 | C21 | C22 | 120.4° | 119.9° |
C24 | C21 | C20 | 121.7° | 120.0° |
C21 | C24 | H241 | 120.1° | 120.0° |
C23 | C22 | C21 | 120.1° | 120.0° |
C23 | C22 | H221 | 119.9° | 120.0° |
C22 | C23 | H231 | 120.3° | 120.0° |
C22 | C21 | C20 | 117.9° | 120.1° |
C21 | C22 | H221 | 119.9° | 120.0° |
C21 | C20 | C19 | 121.8° | 120.4° |
C21 | C20 | C17 | 119.4° | 120.4° |
C20 | C19 | N18 | 121.6° | 120.9° |
C19 | C20 | C17 | 118.8° | 119.2° |
C20 | C19 | H191 | 119.2° | 119.5° |
C19 | N18 | C02 | 120.9° | 121.9° |
N18 | C19 | H191 | 119.2° | 119.5° |
C20 | C17 | C03 | 117.5° | 118.3° |
C20 | C17 | H171 | 121.2° | 120.8° |
N18 | C02 | C03 | 121.1° | 120.7° |
N18 | C02 | N01 | 120.0° | 119.7° |
C17 | C03 | C02 | 120.0° | 119.0° |
C17 | C03 | C04 | 121.4° | 120.5° |
C03 | C17 | H171 | 121.2° | 120.9° |
C03 | C02 | N01 | 118.9° | 119.7° |
C02 | C03 | C04 | 118.6° | 120.5° |
C02 | N01 | H011 | 109.5° | 120.0° |
C02 | N01 | H012 | 109.5° | 120.0° |
C03 | C04 | C16 | 121.4° | 120.1° |
C03 | C04 | C05 | 117.9° | 120.0° |
C16 | C04 | C05 | 120.7° | 119.9° |
C04 | C16 | C13 | 119.6° | 120.0° |
C04 | C16 | H161 | 120.2° | 120.0° |
C04 | C05 | C06 | 119.9° | 119.9° |
C04 | C05 | H051 | 120.0° | 120.1° |
C16 | C13 | O14 | 118.1° | 119.9° |
C16 | C13 | C12 | 119.9° | 120.1° |
C13 | C16 | H161 | 120.2° | 120.0° |
C05 | C06 | C12 | 120.2° | 120.0° |
C05 | C06 | N07 | 118.5° | 120.0° |
C06 | C05 | H051 | 120.1° | 120.0° |
O14 | C13 | C12 | 121.9° | 120.0° |
C13 | O14 | C15 | 113.5° | 117.0° |
C13 | C12 | C06 | 119.7° | 120.1° |
C13 | C12 | H121 | 120.2° | 119.9° |
C12 | C06 | N07 | 121.3° | 120.0° |
C06 | C12 | H121 | 120.1° | 119.9° |
C06 | N07 | S08 | 118.0° | 120.0° |
C06 | N07 | H071 | 107.3° | 119.9° |
O14 | C15 | H153 | 109.5° | 109.5° |
O14 | C15 | H151 | 109.5° | 109.5° |
O14 | C15 | H152 | 109.5° | 109.5° |
C10 | S08 | O09 | 113.6° | 110.5° |
C10 | S08 | N07 | 110.1° | 104.5° |
C10 | S08 | O11 | 113.8° | 110.6° |
S08 | C10 | H101 | 109.5° | 109.5° |
S08 | C10 | H103 | 109.4° | 109.5° |
S08 | C10 | H102 | 109.4° | 109.4° |
O09 | S08 | N07 | 108.6° | 104.3° |
O09 | S08 | O11 | 99.9° | 121.0° |
N07 | S08 | O11 | 110.5° | 104.3° |
S08 | N07 | H071 | 107.3° | 120.0° |
H153 | C15 | H151 | 109.4° | 109.5° |
H153 | C15 | H152 | 109.5° | 109.4° |
H151 | C15 | H152 | 109.5° | 109.5° |
H101 | C10 | H103 | 109.5° | 109.5° |
H101 | C10 | H102 | 109.4° | 109.5° |
H103 | C10 | H102 | 109.5° | 109.5° |
H282 | C28 | H281 | 109.4° | 109.5° |
H291 | C29 | H292 | 109.4° | 109.5° |
H311 | C31 | H312 | 109.5° | 109.4° |
H322 | C32 | H321 | 109.5° | 109.5° |
H011 | N01 | H012 | 109.5° | 120.0° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N30 | C29 | C28 | H291 | 120.5° | 120.0° |
N30 | C29 | C28 | H292 | 120.5° | 119.9° |
C29 | N30 | C31 | H301 | 120.6° | 123.8° |
N30 | C29 | C28 | N27 | 55.6° | 58.5° |
C29 | N30 | C31 | C32 | 52.4° | 59.4° |
N30 | C29 | C28 | H282 | 64.7° | 61.6° |
N30 | C29 | C28 | H281 | 175.8° | 178.4° |
N30 | C29 | H291 | H292 | 118.5° | 120.1° |
C29 | N30 | C31 | H311 | 68.0° | 179.4° |
C29 | N30 | C31 | H312 | 172.8° | 60.6° |
C28 | C29 | N30 | C31 | 53.3° | 59.4° |
C29 | C28 | N27 | H282 | 120.3° | 120.0° |
C29 | C28 | N27 | H281 | 120.3° | 119.9° |
C29 | C28 | N27 | C32 | 55.5° | 59.4° |
C29 | C28 | N27 | C26 | 160.2° | 176.8° |
C29 | C28 | H282 | H281 | 119.2° | 120.0° |
C28 | C29 | H291 | H292 | 118.5° | 120.1° |
C28 | C29 | N30 | H301 | 173.9° | 176.8° |
N30 | C31 | C32 | H311 | 120.4° | 120.0° |
N30 | C31 | C32 | H312 | 120.4° | 120.0° |
N30 | C31 | C32 | N27 | 54.4° | 58.4° |
C31 | N30 | C29 | H291 | 173.8° | 60.6° |
C31 | N30 | C29 | H292 | 67.2° | 179.3° |
N30 | C31 | H311 | H312 | 118.7° | 120.0° |
N30 | C31 | C32 | H322 | 174.8° | 178.3° |
N30 | C31 | C32 | H321 | 65.9° | 61.6° |
C28 | N27 | C32 | C31 | 55.3° | 59.3° |
C28 | N27 | C32 | C26 | 144.9° | 123.9° |
C28 | N27 | C26 | C25 | 49.8° | 180.0° |
C28 | N27 | C26 | C23 | 130.5° | 0.8° |
N27 | C28 | H282 | H281 | 119.2° | 120.0° |
N27 | C28 | C29 | H291 | 176.1° | 61.5° |
N27 | C28 | C29 | H292 | 64.9° | 178.4° |
C28 | N27 | C32 | H322 | 175.7° | 179.3° |
C28 | N27 | C32 | H321 | 65.1° | 60.6° |
C31 | C32 | N27 | H322 | 120.4° | 120.0° |
C31 | C32 | N27 | H321 | 120.4° | 120.0° |
C31 | C32 | N27 | C26 | 159.8° | 176.8° |
C32 | C31 | H311 | H312 | 118.7° | 120.0° |
C31 | C32 | H322 | H321 | 118.8° | 120.1° |
C32 | C31 | N30 | H301 | 173.0° | 176.8° |
C32 | N27 | C26 | C25 | 170.1° | 56.2° |
C32 | N27 | C26 | C23 | 9.6° | 122.9° |
C32 | N27 | C28 | H282 | 64.8° | 60.6° |
C32 | N27 | C28 | H281 | 175.7° | 179.3° |
N27 | C32 | C31 | H311 | 66.0° | 178.4° |
N27 | C32 | C31 | H312 | 174.9° | 61.6° |
N27 | C32 | H322 | H321 | 118.8° | 120.0° |
N27 | C26 | C25 | C23 | 179.7° | 179.1° |
N27 | C26 | C25 | C24 | 179.8° | 180.0° |
N27 | C26 | C23 | C22 | 179.7° | 179.7° |
N27 | C26 | C23 | H231 | 0.3° | 0.3° |
N27 | C26 | C25 | H251 | 0.3° | 0.9° |
C26 | N27 | C28 | H282 | 79.5° | 63.2° |
C26 | N27 | C28 | H281 | 40.0° | 56.8° |
C26 | N27 | C32 | H322 | 39.4° | 56.8° |
C26 | N27 | C32 | H321 | 79.8° | 63.2° |
C26 | C25 | C24 | H251 | 180.0° | 179.1° |
C26 | C25 | C24 | C21 | 0.2° | 0.6° |
C25 | C26 | C23 | C22 | 0.0° | 0.6° |
C25 | C26 | C23 | H231 | 180.0° | 179.4° |
C26 | C25 | C24 | H241 | 179.7° | 179.4° |
C24 | C25 | C26 | C23 | 0.1° | 0.9° |
C25 | C24 | C21 | H241 | 180.0° | 180.0° |
C25 | C24 | C21 | C22 | 0.3° | 0.0° |
C25 | C24 | C21 | C20 | 179.7° | 179.7° |
C26 | C23 | C22 | H231 | 180.0° | 180.0° |
C26 | C23 | C22 | C21 | 0.1° | 0.0° |
C26 | C23 | C22 | H221 | 179.9° | 179.9° |
C23 | C26 | C25 | H251 | 179.9° | 180.0° |
C24 | C21 | C22 | C23 | 0.3° | 0.3° |
C24 | C21 | C22 | C20 | 180.0° | 179.7° |
C24 | C21 | C20 | C19 | 18.9° | 179.7° |
C24 | C21 | C20 | C17 | 160.9° | 0.3° |
C24 | C21 | C22 | H221 | 179.7° | 179.8° |
C21 | C24 | C25 | H251 | 179.8° | 179.7° |
C23 | C22 | C21 | H221 | 180.0° | 179.9° |
C23 | C22 | C21 | C20 | 179.7° | 180.0° |
C22 | C21 | C20 | C19 | 161.1° | 0.1° |
C22 | C21 | C20 | C17 | 19.1° | 180.0° |
C21 | C22 | C23 | H231 | 179.9° | 180.0° |
C22 | C21 | C24 | H241 | 179.6° | 179.9° |
C21 | C20 | C19 | C17 | 179.8° | 180.0° |
C21 | C20 | C19 | N18 | 179.8° | 180.0° |
C21 | C20 | C17 | C03 | 180.0° | 179.9° |
C21 | C20 | C19 | H191 | 0.2° | 0.3° |
C21 | C20 | C17 | H171 | 0.0° | 0.0° |
C20 | C21 | C22 | H221 | 0.2° | 0.1° |
C20 | C21 | C24 | H241 | 0.3° | 0.3° |
C20 | C19 | N18 | H191 | 180.0° | 179.7° |
C20 | C19 | N18 | C02 | 0.0° | 0.0° |
C19 | C20 | C17 | C03 | 0.2° | 0.0° |
C19 | C20 | C17 | H171 | 179.8° | 179.9° |
N18 | C19 | C20 | C17 | 0.4° | 0.0° |
C19 | N18 | C02 | C03 | 0.5° | 0.0° |
C19 | N18 | C02 | N01 | 179.7° | 180.0° |
C20 | C17 | C03 | H171 | 180.0° | 179.9° |
C20 | C17 | C03 | C02 | 0.3° | 0.1° |
C20 | C17 | C03 | C04 | 179.6° | 180.0° |
C17 | C20 | C19 | H191 | 179.6° | 179.7° |
N18 | C02 | C03 | C17 | 0.7° | 0.0° |
N18 | C02 | C03 | N01 | 179.7° | 180.0° |
N18 | C02 | C03 | C04 | 180.0° | 180.0° |
C02 | N18 | C19 | H191 | 180.0° | 179.7° |
N18 | C02 | N01 | H011 | 0.0° | 180.0° |
N18 | C02 | N01 | H012 | 120.0° | 0.0° |
C17 | C03 | C02 | C04 | 179.3° | 180.0° |
C17 | C03 | C02 | N01 | 179.6° | 179.9° |
C17 | C03 | C04 | C16 | 126.7° | 50.1° |
C17 | C03 | C04 | C05 | 53.5° | 130.0° |
C02 | C03 | C04 | C16 | 54.0° | 130.0° |
C02 | C03 | C04 | C05 | 125.8° | 50.0° |
C02 | C03 | C17 | H171 | 179.7° | 180.0° |
C03 | C02 | N01 | H011 | 179.7° | 0.0° |
C03 | C02 | N01 | H012 | 59.7° | 180.0° |
N01 | C02 | C03 | C04 | 0.3° | 0.0° |
C02 | N01 | H011 | H012 | 120.0° | 180.0° |
C03 | C04 | C16 | C05 | 179.9° | 179.9° |
C03 | C04 | C16 | C13 | 179.8° | 179.9° |
C03 | C04 | C05 | C06 | 179.6° | 179.7° |
C03 | C04 | C16 | H161 | 0.1° | 0.1° |
C04 | C03 | C17 | H171 | 0.4° | 0.1° |
C03 | C04 | C05 | H051 | 0.4° | 0.0° |
C04 | C16 | C13 | H161 | 180.0° | 180.0° |
C16 | C04 | C05 | C06 | 0.3° | 0.2° |
C04 | C16 | C13 | O14 | 179.8° | 179.9° |
C04 | C16 | C13 | C12 | 0.0° | 0.1° |
C16 | C04 | C05 | H051 | 179.7° | 179.9° |
C05 | C04 | C16 | C13 | 0.0° | 0.0° |
C04 | C05 | C06 | H051 | 180.0° | 179.7° |
C04 | C05 | C06 | C12 | 0.5° | 0.6° |
C04 | C05 | C06 | N07 | 180.0° | 180.0° |
C05 | C04 | C16 | H161 | 180.0° | 180.0° |
C16 | C13 | O14 | C12 | 179.9° | 179.9° |
C16 | C13 | C12 | C06 | 0.2° | 0.4° |
C16 | C13 | O14 | C15 | 123.0° | 179.9° |
C16 | C13 | C12 | H121 | 179.8° | 180.0° |
C05 | C06 | C12 | C13 | 0.5° | 0.6° |
C05 | C06 | C12 | N07 | 179.4° | 179.4° |
C05 | C06 | N07 | S08 | 121.7° | 104.7° |
C05 | C06 | C12 | H121 | 179.5° | 179.7° |
C05 | C06 | N07 | H071 | 0.5° | 75.2° |
O14 | C13 | C12 | C06 | 179.9° | 179.7° |
C13 | O14 | C15 | H153 | 180.0° | 180.0° |
C13 | O14 | C15 | H151 | 60.0° | 60.0° |
C13 | O14 | C15 | H152 | 60.0° | 60.0° |
O14 | C13 | C12 | H121 | 0.1° | 0.1° |
O14 | C13 | C16 | H161 | 0.2° | 0.1° |
C13 | C12 | C06 | H121 | 180.0° | 179.7° |
C13 | C12 | C06 | N07 | 179.9° | 180.0° |
C12 | C13 | O14 | C15 | 57.1° | 0.0° |
C12 | C13 | C16 | H161 | 179.9° | 180.0° |
C12 | C06 | N07 | S08 | 57.7° | 74.7° |
C12 | C06 | C05 | H051 | 179.5° | 179.7° |
C12 | C06 | N07 | H071 | 179.0° | 105.4° |
C06 | N07 | S08 | C10 | 128.2° | 64.3° |
C06 | N07 | S08 | O09 | 3.3° | 179.7° |
C06 | N07 | S08 | H071 | 121.2° | 180.0° |
C06 | N07 | S08 | O11 | 105.3° | 51.8° |
N07 | C06 | C12 | H121 | 0.1° | 0.3° |
N07 | C06 | C05 | H051 | 0.0° | 0.3° |
O14 | C15 | H153 | H151 | 120.0° | 120.0° |
O14 | C15 | H153 | H152 | 120.0° | 120.0° |
O14 | C15 | H151 | H152 | 120.0° | 120.0° |
C10 | S08 | O09 | N07 | 122.8° | 111.7° |
C10 | S08 | O09 | O11 | 121.5° | 131.5° |
C10 | S08 | N07 | O11 | 126.5° | 116.1° |
S08 | C10 | H101 | H103 | 120.0° | 120.0° |
S08 | C10 | H101 | H102 | 120.0° | 120.0° |
S08 | C10 | H103 | H102 | 120.0° | 120.0° |
C10 | S08 | N07 | H071 | 6.9° | 115.7° |
O09 | S08 | N07 | O11 | 108.6° | 127.9° |
O09 | S08 | C10 | H101 | 180.0° | 46.7° |
O09 | S08 | C10 | H103 | 60.0° | 73.3° |
O09 | S08 | C10 | H102 | 60.0° | 166.7° |
O09 | S08 | N07 | H071 | 117.9° | 0.3° |
N07 | S08 | C10 | H101 | 58.0° | 64.9° |
N07 | S08 | C10 | H103 | 178.1° | 175.1° |
N07 | S08 | C10 | H102 | 61.9° | 55.0° |
O11 | S08 | C10 | H101 | 66.6° | 176.5° |
O11 | S08 | C10 | H103 | 53.4° | 63.4° |
O11 | S08 | C10 | H102 | 173.4° | 56.6° |
O11 | S08 | N07 | H071 | 133.4° | 128.2° |
H153 | C15 | H151 | H152 | 120.0° | 120.0° |
H101 | C10 | H103 | H102 | 120.0° | 120.0° |
H221 | C22 | C23 | H231 | 0.1° | 0.1° |
H241 | C24 | C25 | H251 | 0.2° | 0.3° |
H282 | C28 | C29 | H291 | 55.8° | 178.5° |
H282 | C28 | C29 | H292 | 174.8° | 58.3° |
H281 | C28 | C29 | H291 | 63.7° | 58.4° |
H281 | C28 | C29 | H292 | 55.3° | 61.7° |
H291 | C29 | N30 | H301 | 65.6° | 63.2° |
H292 | C29 | N30 | H301 | 53.4° | 56.9° |
H311 | C31 | C32 | H322 | 54.4° | 61.7° |
H311 | C31 | C32 | H321 | 173.6° | 58.4° |
H311 | C31 | N30 | H301 | 52.6° | 56.8° |
H312 | C31 | C32 | H322 | 64.7° | 58.3° |
H312 | C31 | C32 | H321 | 54.5° | 178.4° |
H312 | C31 | N30 | H301 | 66.6° | 63.2° |