4S8
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C3P | N4P | sing | 1.47Å | 1.47Å | |
C3P | C2P | sing | 1.53Å | 1.54Å | |
S1P | C2P | sing | 1.81Å | 1.82Å | |
N4P | C5P | sing | 1.35Å | 1.33Å | |
C5P | O5P | doub | 1.21Å | 1.22Å | |
C5P | C6P | sing | 1.51Å | 1.52Å | |
C6P | C7P | sing | 1.53Å | 1.54Å | |
C7P | N8P | sing | 1.47Å | 1.46Å | |
N8P | C9P | sing | 1.35Å | 1.34Å | |
OAP | CAP | sing | 1.43Å | 1.44Å | |
C9P | CAP | sing | 1.51Å | 1.53Å | |
C9P | O9P | doub | 1.21Å | 1.23Å | |
CAP | CBP | sing | 1.53Å | 1.54Å | |
CEP | CBP | sing | 1.53Å | 1.52Å | |
CBP | CCP | sing | 1.53Å | 1.52Å | |
CBP | CDP | sing | 1.53Å | 1.52Å | |
CCP | O6A | sing | 1.43Å | 1.44Å | |
O3A | P2A | sing | 1.61Å | 1.52Å | |
O6A | P2A | sing | 1.61Å | 1.63Å | |
P2A | O4A | sing | 1.61Å | 1.50Å | |
O3A | H1 | sing | 0.97Å | 0.95Å | |
O4A | H2 | sing | 0.97Å | 0.95Å | |
CCP | H3 | sing | 1.09Å | 1.10Å | |
CCP | H4 | sing | 1.09Å | 1.10Å | |
CDP | H5 | sing | 1.09Å | 1.10Å | |
CDP | H6 | sing | 1.09Å | 1.10Å | |
CDP | H7 | sing | 1.09Å | 1.10Å | |
CEP | H8 | sing | 1.09Å | 1.10Å | |
CEP | H9 | sing | 1.09Å | 1.10Å | |
CEP | H10 | sing | 1.09Å | 1.10Å | |
CAP | H11 | sing | 1.09Å | 1.10Å | |
OAP | H12 | sing | 0.97Å | 0.95Å | |
N8P | H13 | sing | 0.97Å | 1.00Å | |
C7P | H14 | sing | 1.09Å | 1.10Å | |
C7P | H15 | sing | 1.09Å | 1.10Å | |
C6P | H16 | sing | 1.09Å | 1.10Å | |
C6P | H17 | sing | 1.09Å | 1.10Å | |
N4P | H18 | sing | 0.97Å | 1.00Å | |
C3P | H19 | sing | 1.09Å | 1.10Å | |
C3P | H20 | sing | 1.09Å | 1.10Å | |
C2P | H21 | sing | 1.09Å | 1.10Å | |
C2P | H22 | sing | 1.09Å | 1.10Å | |
S1P | H23 | sing | 1.34Å | 1.30Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
N4P | C3P | C2P | 107.6° | 109.4° |
C3P | N4P | C5P | 124.3° | 119.9° |
C3P | N4P | H18 | 117.8° | 120.0° |
N4P | C3P | H19 | 109.9° | 109.5° |
N4P | C3P | H20 | 109.9° | 109.4° |
C3P | C2P | S1P | 113.1° | 109.5° |
C2P | C3P | H19 | 109.9° | 109.5° |
C2P | C3P | H20 | 109.9° | 109.5° |
C3P | C2P | H21 | 108.6° | 109.5° |
C3P | C2P | H22 | 108.6° | 109.4° |
S1P | C2P | H21 | 108.5° | 109.5° |
S1P | C2P | H22 | 108.6° | 109.5° |
C2P | S1P | H23 | 102.0° | 103.0° |
N4P | C5P | O5P | 119.1° | 120.0° |
N4P | C5P | C6P | 121.1° | 120.0° |
C5P | N4P | H18 | 117.9° | 120.0° |
O5P | C5P | C6P | 119.8° | 120.0° |
C5P | C6P | C7P | 108.0° | 109.4° |
C5P | C6P | H16 | 109.9° | 109.4° |
C5P | C6P | H17 | 109.8° | 109.5° |
C6P | C7P | N8P | 109.5° | 109.5° |
C6P | C7P | H14 | 109.5° | 109.5° |
C6P | C7P | H15 | 109.5° | 109.5° |
C7P | C6P | H16 | 109.8° | 109.5° |
C7P | C6P | H17 | 109.9° | 109.5° |
C7P | N8P | C9P | 125.2° | 120.0° |
C7P | N8P | H13 | 117.4° | 120.0° |
N8P | C7P | H14 | 109.5° | 109.5° |
N8P | C7P | H15 | 109.4° | 109.4° |
N8P | C9P | CAP | 119.1° | 120.0° |
N8P | C9P | O9P | 119.3° | 120.0° |
C9P | N8P | H13 | 117.4° | 120.0° |
OAP | CAP | C9P | 112.4° | 109.4° |
OAP | CAP | CBP | 109.3° | 109.5° |
OAP | CAP | H11 | 107.6° | 109.4° |
CAP | OAP | H12 | 109.5° | 114.0° |
CAP | C9P | O9P | 121.5° | 120.0° |
C9P | CAP | CBP | 114.3° | 109.5° |
C9P | CAP | H11 | 106.5° | 109.5° |
CAP | CBP | CEP | 110.4° | 109.5° |
CAP | CBP | CCP | 110.4° | 109.4° |
CAP | CBP | CDP | 110.3° | 109.5° |
CBP | CAP | H11 | 106.3° | 109.5° |
CEP | CBP | CCP | 109.4° | 109.5° |
CEP | CBP | CDP | 112.0° | 109.5° |
CBP | CEP | H8 | 109.5° | 109.5° |
CBP | CEP | H9 | 109.5° | 109.5° |
CBP | CEP | H10 | 109.4° | 109.5° |
CCP | CBP | CDP | 104.1° | 109.5° |
CBP | CCP | O6A | 109.6° | 109.4° |
CBP | CCP | H3 | 109.4° | 109.5° |
CBP | CCP | H4 | 109.4° | 109.5° |
CBP | CDP | H5 | 109.5° | 109.5° |
CBP | CDP | H6 | 109.5° | 109.5° |
CBP | CDP | H7 | 109.5° | 109.5° |
CCP | O6A | P2A | 121.5° | 123.0° |
O6A | CCP | H3 | 109.4° | 109.4° |
O6A | CCP | H4 | 109.4° | 109.4° |
O3A | P2A | O6A | 108.5° | 102.0° |
O3A | P2A | O4A | 117.3° | 102.0° |
P2A | O3A | H1 | 109.5° | 114.0° |
O6A | P2A | O4A | 106.4° | 102.0° |
P2A | O4A | H2 | 109.5° | 113.9° |
H3 | CCP | H4 | 109.5° | 109.5° |
H5 | CDP | H6 | 109.4° | 109.4° |
H5 | CDP | H7 | 109.4° | 109.5° |
H6 | CDP | H7 | 109.5° | 109.5° |
H8 | CEP | H9 | 109.4° | 109.5° |
H8 | CEP | H10 | 109.5° | 109.4° |
H9 | CEP | H10 | 109.5° | 109.4° |
H14 | C7P | H15 | 109.5° | 109.5° |
H16 | C6P | H17 | 109.5° | 109.5° |
H19 | C3P | H20 | 109.5° | 109.5° |
H21 | C2P | H22 | 109.4° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
N4P | C3P | C2P | H19 | 119.7° | 120.0° |
N4P | C3P | C2P | H20 | 119.7° | 119.9° |
N4P | C3P | C2P | S1P | 142.8° | 180.0° |
C3P | N4P | C5P | H18 | 180.0° | 180.0° |
C3P | N4P | C5P | O5P | 1.3° | 0.0° |
C3P | N4P | C5P | C6P | 179.5° | 180.0° |
N4P | C3P | H19 | H20 | 120.8° | 120.0° |
N4P | C3P | C2P | H21 | 96.6° | 59.9° |
N4P | C3P | C2P | H22 | 22.3° | 60.0° |
C3P | C2P | S1P | H21 | 120.6° | 120.0° |
C3P | C2P | S1P | H22 | 120.6° | 120.0° |
C2P | C3P | N4P | C5P | 113.8° | 180.0° |
C2P | C3P | N4P | H18 | 66.2° | 0.0° |
C2P | C3P | H19 | H20 | 120.9° | 120.1° |
C3P | C2P | H21 | H22 | 118.3° | 120.0° |
C3P | C2P | S1P | H23 | 180.0° | 180.0° |
S1P | C2P | C3P | H19 | 23.1° | 60.0° |
S1P | C2P | C3P | H20 | 97.5° | 60.1° |
S1P | C2P | H21 | H22 | 118.3° | 120.0° |
N4P | C5P | O5P | C6P | 179.2° | 180.0° |
N4P | C5P | C6P | C7P | 179.0° | 180.0° |
N4P | C5P | C6P | H16 | 61.3° | 60.0° |
N4P | C5P | C6P | H17 | 59.2° | 60.0° |
C5P | N4P | C3P | H19 | 126.5° | 60.0° |
C5P | N4P | C3P | H20 | 5.9° | 60.0° |
O5P | C5P | C6P | C7P | 0.2° | 0.0° |
O5P | C5P | C6P | H16 | 119.5° | 120.0° |
O5P | C5P | C6P | H17 | 120.0° | 120.0° |
O5P | C5P | N4P | H18 | 178.7° | 180.0° |
C5P | C6P | C7P | H16 | 119.8° | 120.0° |
C5P | C6P | C7P | H17 | 119.7° | 120.0° |
C5P | C6P | C7P | N8P | 178.2° | 180.0° |
C5P | C6P | C7P | H14 | 61.8° | 60.0° |
C5P | C6P | C7P | H15 | 58.2° | 60.0° |
C5P | C6P | H16 | H17 | 120.7° | 120.0° |
C6P | C5P | N4P | H18 | 0.5° | 0.0° |
C6P | C7P | N8P | H14 | 120.0° | 120.0° |
C6P | C7P | N8P | H15 | 120.0° | 120.0° |
C6P | C7P | N8P | C9P | 80.8° | 179.9° |
C6P | C7P | N8P | H13 | 99.2° | 0.0° |
C6P | C7P | H14 | H15 | 120.0° | 120.1° |
C7P | C6P | H16 | H17 | 120.7° | 120.0° |
C7P | N8P | C9P | H13 | 180.0° | 179.9° |
C7P | N8P | C9P | CAP | 178.9° | 175.6° |
C7P | N8P | C9P | O9P | 2.1° | 4.4° |
N8P | C7P | H14 | H15 | 120.0° | 119.9° |
N8P | C7P | C6P | H16 | 58.4° | 60.0° |
N8P | C7P | C6P | H17 | 62.1° | 60.0° |
N8P | C9P | CAP | OAP | 2.1° | 171.9° |
N8P | C9P | CAP | O9P | 176.7° | 180.0° |
N8P | C9P | CAP | CBP | 123.3° | 68.1° |
N8P | C9P | CAP | H11 | 119.6° | 51.9° |
C9P | N8P | C7P | H14 | 39.2° | 59.9° |
C9P | N8P | C7P | H15 | 159.2° | 60.0° |
OAP | CAP | C9P | CBP | 125.3° | 120.0° |
OAP | CAP | C9P | H11 | 117.5° | 120.0° |
OAP | CAP | C9P | O9P | 174.6° | 8.2° |
OAP | CAP | CBP | H11 | 115.8° | 120.0° |
OAP | CAP | CBP | CEP | 72.8° | 54.3° |
OAP | CAP | CBP | CCP | 48.4° | 65.7° |
OAP | CAP | CBP | CDP | 162.9° | 174.3° |
C9P | CAP | CBP | H11 | 117.2° | 120.1° |
C9P | CAP | CBP | CEP | 54.2° | 174.2° |
C9P | CAP | CBP | CCP | 175.3° | 54.2° |
C9P | CAP | CBP | CDP | 70.2° | 65.7° |
C9P | CAP | OAP | H12 | 180.0° | 60.1° |
CAP | C9P | N8P | H13 | 1.2° | 4.5° |
O9P | C9P | CAP | CBP | 60.1° | 111.8° |
O9P | C9P | CAP | H11 | 57.1° | 128.1° |
O9P | C9P | N8P | H13 | 177.9° | 175.5° |
CAP | CBP | CEP | CCP | 121.7° | 120.0° |
CAP | CBP | CEP | CDP | 123.4° | 120.0° |
CAP | CBP | CCP | CDP | 118.4° | 120.0° |
CAP | CBP | CCP | O6A | 174.9° | 180.0° |
CAP | CBP | CCP | H3 | 54.9° | 60.0° |
CAP | CBP | CCP | H4 | 65.1° | 60.0° |
CAP | CBP | CDP | H5 | 180.0° | 173.6° |
CAP | CBP | CDP | H6 | 60.0° | 53.6° |
CAP | CBP | CDP | H7 | 60.0° | 66.4° |
CAP | CBP | CEP | H8 | 180.0° | 56.6° |
CAP | CBP | CEP | H9 | 60.0° | 63.4° |
CAP | CBP | CEP | H10 | 60.0° | 176.6° |
CBP | CAP | OAP | H12 | 52.0° | 60.0° |
CEP | CBP | CCP | CDP | 119.9° | 120.1° |
CEP | CBP | CCP | O6A | 53.2° | 60.0° |
CEP | CBP | CCP | H3 | 66.9° | 59.9° |
CEP | CBP | CCP | H4 | 173.2° | 180.0° |
CEP | CBP | CDP | H5 | 56.6° | 53.5° |
CEP | CBP | CDP | H6 | 176.6° | 66.4° |
CEP | CBP | CDP | H7 | 63.4° | 173.6° |
CBP | CEP | H8 | H9 | 120.0° | 120.0° |
CBP | CEP | H8 | H10 | 120.0° | 120.0° |
CBP | CEP | H9 | H10 | 120.0° | 120.0° |
CEP | CBP | CAP | H11 | 171.4° | 65.7° |
CBP | CCP | O6A | H3 | 120.0° | 120.0° |
CBP | CCP | O6A | H4 | 120.0° | 120.0° |
CBP | CCP | O6A | P2A | 171.0° | 180.0° |
CBP | CCP | H3 | H4 | 119.9° | 120.1° |
CCP | CBP | CDP | H5 | 61.6° | 66.5° |
CCP | CBP | CDP | H6 | 58.4° | 173.6° |
CCP | CBP | CDP | H7 | 178.5° | 53.5° |
CCP | CBP | CEP | H8 | 58.3° | 63.4° |
CCP | CBP | CEP | H9 | 178.3° | 176.6° |
CCP | CBP | CEP | H10 | 61.7° | 56.7° |
CCP | CBP | CAP | H11 | 67.5° | 174.3° |
CDP | CBP | CCP | O6A | 66.7° | 60.0° |
CDP | CBP | CCP | H3 | 173.3° | 180.0° |
CDP | CBP | CCP | H4 | 53.4° | 60.0° |
CBP | CDP | H5 | H6 | 120.0° | 120.0° |
CBP | CDP | H5 | H7 | 120.0° | 120.0° |
CBP | CDP | H6 | H7 | 120.0° | 120.0° |
CDP | CBP | CEP | H8 | 56.6° | 176.6° |
CDP | CBP | CEP | H9 | 63.4° | 56.6° |
CDP | CBP | CEP | H10 | 176.6° | 63.4° |
CDP | CBP | CAP | H11 | 47.1° | 54.3° |
CCP | O6A | P2A | O3A | 57.4° | 89.8° |
CCP | O6A | P2A | O4A | 175.5° | 165.0° |
O6A | CCP | H3 | H4 | 119.9° | 120.0° |
O3A | P2A | O6A | O4A | 127.1° | 105.2° |
O3A | P2A | O4A | H2 | 180.0° | 74.7° |
O6A | P2A | O3A | H1 | 180.0° | 74.8° |
O6A | P2A | O4A | H2 | 58.4° | 179.9° |
P2A | O6A | CCP | H3 | 50.9° | 60.0° |
P2A | O6A | CCP | H4 | 69.0° | 60.0° |
O4A | P2A | O3A | H1 | 59.5° | 180.0° |
H5 | CDP | H6 | H7 | 119.9° | 120.0° |
H8 | CEP | H9 | H10 | 120.0° | 119.9° |
H11 | CAP | OAP | H12 | 63.1° | 180.0° |
H13 | N8P | C7P | H14 | 140.8° | 120.0° |
H13 | N8P | C7P | H15 | 20.8° | 120.1° |
H14 | C7P | C6P | H16 | 178.4° | 180.0° |
H14 | C7P | C6P | H17 | 57.9° | 60.0° |
H15 | C7P | C6P | H16 | 61.6° | 59.9° |
H15 | C7P | C6P | H17 | 177.9° | 180.0° |
H18 | N4P | C3P | H19 | 53.5° | 120.0° |
H18 | N4P | C3P | H20 | 174.1° | 120.0° |
H19 | C3P | C2P | H21 | 143.7° | 179.9° |
H19 | C3P | C2P | H22 | 97.4° | 59.9° |
H20 | C3P | C2P | H21 | 23.1° | 60.0° |
H20 | C3P | C2P | H22 | 142.0° | 180.0° |
H21 | C2P | S1P | H23 | 59.4° | 60.0° |
H22 | C2P | S1P | H23 | 59.4° | 60.0° |