List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
154989 |
56314549 |
1 |
SN3O4C20H25 |
AB3C4D20E25 |
-102.73 |
7.51 |
-9.09 |
-0.96 |
0 |
|
|
154990 |
56314550 |
1 |
BrN3O4C22H24 |
AB3C4D22E24 |
-115.94 |
6.42 |
-9.45 |
-0.92 |
0 |
|
|
154991 |
56314551 |
1 |
OSN7C24H25 |
ABC7D24E25 |
102.59 |
3.69 |
-8.39 |
-1.13 |
0 |
|
|
154992 |
56314552 |
1 |
O2N6C25H36 |
A2B6C25D36 |
-41.47 |
3.46 |
-8.79 |
-0.46 |
0 |
|
|
154993 |
56314553 |
1 |
SO2N5H25C26 |
AB2C5D25E26 |
44.66 |
3.7 |
-9.21 |
-1.17 |
0 |
|
|
154994 |
56314554 |
1 |
SN2O3C22H24 |
AB2C3D22E24 |
-75.94 |
9.35 |
-8.56 |
-0.74 |
0 |
|
|
154995 |
56314556 |
1 |
SO2N5C22H23 |
AB2C5D22E23 |
30.97 |
6.11 |
-9.24 |
-1.22 |
0 |
|
|
154996 |
56314557 |
1 |
BrN3O3C21H26 |
AB3C3D21E26 |
-100.5 |
6.61 |
-9.29 |
-0.92 |
0 |
|
|
154997 |
56314560 |
1 |
SN3O5C19H23 |
AB3C5D19E23 |
-168.21 |
6.03 |
-9.09 |
-0.96 |
0 |
|
|
154998 |
56314561 |
1 |
SN2F3O5C18H19 |
AB2C3D5E18F19 |
-307.52 |
4.23 |
-9.94 |
-1.14 |
0 |
|
|
154999 |
56314562 |
1 |
BrO2N4C21H21 |
AB2C4D21E21 |
-10.64 |
5.59 |
-8.9 |
-0.64 |
0 |
|
|
155000 |
56314563 |
1 |
ClN3O3H20C21 |
AB3C3D20E21 |
-50.16 |
3.22 |
-9.32 |
-1.31 |
0 |
|
|
155001 |
56314564 |
1 |
O2N3C24H27 |
A2B3C24D27 |
-17.37 |
6.96 |
-8.36 |
-0.07 |
0 |
|
|
155002 |
56314565 |
1 |
N3O3C23H25 |
A3B3C23D25 |
-73.03 |
7.26 |
-8.54 |
-0.78 |
0 |
|
|
155003 |
56314569 |
1 |
FSN3O4C19H20 |
ABC3D4E19F20 |
-132.51 |
3.42 |
-9.24 |
-1.25 |
0 |
|
|
155004 |
56314570 |
1 |
BrO2N3C21H30 |
AB2C3D21E30 |
-87.93 |
3.17 |
-8.4 |
-0.78 |
0 |
|
|
155005 |
56314571 |
1 |
N3O3C25H33 |
A3B3C25D33 |
-85.11 |
7.61 |
-8.36 |
0.02 |
0 |
|
|
155006 |
56314572 |
1 |
O2N3C21H33 |
A2B3C21D33 |
-110.7 |
7.28 |
-8.35 |
-0.12 |
0 |
|
|
155007 |
56314573 |
1 |
ClSO2N5H20C25 |
ABC2D5E20F25 |
65.53 |
5.69 |
-9.19 |
-1.17 |
0 |
|
|
155008 |
56314574 |
1 |
N4O5H22C24 |
A4B5C22D24 |
-118.59 |
4.52 |
-9.18 |
-1.29 |
0 |
|
|
155009 |
56314575 |
1 |
N3O6H25C26 |
A3B6C25D26 |
-164.12 |
2.7 |
-8.72 |
-0.64 |
0 |
|
|
155010 |
56314576 |
1 |
SO2N6C26H34 |
AB2C6D26E34 |
1.99 |
7.2 |
-8.74 |
-1.06 |
0 |
|
|
155011 |
56314577 |
1 |
SO2N4H14C18 |
AB2C4D14E18 |
59.68 |
5.23 |
-9.17 |
-1.17 |
0 |
|
|
155012 |
56314578 |
1 |
ClSO4N5C18H18 |
ABC4D5E18F18 |
-92.14 |
2.95 |
-9.12 |
-1.4 |
0 |
|
|
155013 |
56314579 |
1 |
N4O4C27H28 |
A4B4C27D28 |
-106.97 |
5.95 |
-8.43 |
-0.63 |
0 |
|
|
155014 |
56314580 |
1 |
SO2N5H21C22 |
AB2C5D21E22 |
60.23 |
7.87 |
-9.24 |
-1.29 |
0 |
|
|
155015 |
56314581 |
1 |
BrN3O3C22H30 |
AB3C3D22E30 |
-122.41 |
9.32 |
-9.5 |
-0.51 |
0 |
|
|
155016 |
56314585 |
1 |
F2N2O5C20H28 |
A2B2C5D20E28 |
-331.03 |
5.35 |
-9.32 |
-0.47 |
0 |
|
|
155017 |
56314586 |
1 |
SN3O4C22H29 |
AB3C4D22E29 |
-148.74 |
6.07 |
-9.06 |
-1.02 |
0 |
|
|
155018 |
56314587 |
1 |
N3O5C22H31 |
A3B5C22D31 |
-217.27 |
8.18 |
-9.02 |
-0.39 |
0 |
|
|
155019 |
56314588 |
1 |
SN2O5C20H30 |
AB2C5D20E30 |
-234.19 |
10.32 |
-9.35 |
-0.31 |
0 |
|
|
155020 |
56314589 |
1 |
FSN3O5C22H34 |
ABC3D5E22F34 |
-282.73 |
9.72 |
-9.49 |
-0.68 |
0 |
|
|
155021 |
56314591 |
1 |
BrSN3O4C19H26 |
ABC3D4E19F26 |
-151.65 |
3.37 |
-9.39 |
-0.62 |
0 |
|
|
155022 |
56314592 |
2 |
N2O2C11H15 |
A2B2C11D15 |
-172.52 |
4.48 |
-8.71 |
-0.5 |
0 |
|
|
155023 |
56314593 |
1 |
S2O3N4C19H28 |
A2B3C4D19E28 |
-113.03 |
5.27 |
-8.59 |
-0.95 |
0 |
|
|
155024 |
56314594 |
1 |
N3O5C21H31 |
A3B5C21D31 |
-236.4 |
5.39 |
-9.4 |
-1.2 |
0 |
|
|
155025 |
56314595 |
1 |
SF3N3O3C21H26 |
AB3C3D3E21F26 |
-286.5 |
5.04 |
-9.24 |
-1.58 |
0 |
|
|
155026 |
56314596 |
1 |
O2N4C25H32 |
A2B4C25D32 |
-23.03 |
11.08 |
-8.64 |
-0.61 |
0 |
|
|
155027 |
56314597 |
1 |
BrO2N3C20H28 |
AB2C3D20E28 |
-81.0 |
4.19 |
-8.82 |
-0.62 |
0 |
|
|
155028 |
56314643 |
1 |
FSO3N4H19C20 |
ABC3D4E19F20 |
-94.5 |
6.42 |
-9.24 |
-1.16 |
0 |
|
|
155029 |
56314646 |
1 |
FSO2N5H18C22 |
ABC2D5E18F22 |
-0.23 |
9.47 |
-8.24 |
-1.45 |
0 |
|
|
155030 |
56314647 |
1 |
F2S2O3N4C22H22 |
A2B2C3D4E22F22 |
-133.65 |
3.84 |
-9.31 |
-0.87 |
0 |
|
|
155031 |
56314649 |
1 |
BrFOSN3C19H23 |
ABCDE3F19G23 |
-43.92 |
1.98 |
-8.49 |
-1.11 |
0 |
|
|
155032 |
56314650 |
1 |
FSO2N6C22H29 |
ABC2D6E22F29 |
-78.66 |
6.67 |
-8.45 |
-0.75 |
0 |
|
|
155033 |
56314658 |
1 |
FSO2N3C23H28 |
ABC2D3E23F28 |
-110.55 |
4.3 |
-8.45 |
-0.38 |
0 |
|
|
155034 |
56314675 |
1 |
SO2N3C25H31 |
AB2C3D25E31 |
-62.54 |
2.69 |
-8.54 |
-0.1 |
0 |
|
|
155035 |
56314824 |
1 |
ON4C25H30 |
AB4C25D30 |
7.14 |
5.14 |
-8.41 |
-0.49 |
0 |
|
|
155036 |
56314826 |
1 |
OS2N5C23H23 |
AB2C5D23E23 |
97.7 |
5.44 |
-8.78 |
-1.12 |
0 |
|
|
155037 |
56314828 |
1 |
ON6C26H30 |
AB6C26D30 |
60.49 |
9.16 |
-8.86 |
-0.83 |
0 |
|
|
155038 |
56314829 |
1 |
OSN4H22C24 |
ABC4D22E24 |
81.45 |
6.32 |
-9.06 |
-1.05 |
0 |
|
|
155039 |
56314830 |
1 |
O2N5C26H33 |
A2B5C26D33 |
-8.88 |
6.47 |
-8.75 |
-0.48 |
0 |
|
|
155040 |
56314831 |
1 |
SN2O5C21H32 |
AB2C5D21E32 |
-199.62 |
7.23 |
-8.68 |
-0.94 |
0 |
|
|
155041 |
56314833 |
1 |
ClSN4O6C19H23 |
ABC4D6E19F23 |
-228.43 |
5.15 |
-9.33 |
-1.21 |
0 |
|
|
155042 |
56314869 |
1 |
N2S2O3C16H24 |
A2B2C3D16E24 |
-118.04 |
7.14 |
-8.96 |
-0.63 |
0 |
|
|
155043 |
56314870 |
1 |
SF2N3O4H19C20 |
AB2C3D4E19F20 |
-208.84 |
7.3 |
-9.47 |
-0.95 |
0 |
|
|
155044 |
56314872 |
1 |
SN3O6C24H29 |
AB3C6D24E29 |
-202.49 |
7.03 |
-9.07 |
-0.64 |
0 |
|
|
155045 |
56314873 |
1 |
SN4O5H18C19 |
AB4C5D18E19 |
-151.17 |
8.18 |
-9.21 |
-1.08 |
0 |
|
|
155046 |
56317838 |
1 |
FN2O2S2H15C18 |
AB2C2D2E15F18 |
-33.15 |
5.79 |
-8.81 |
-0.71 |
0 |
|
|
155047 |
56317839 |
1 |
SN3O3H15C19 |
AB3C3D15E19 |
5.18 |
4.64 |
-9.11 |
-0.95 |
0 |
|
|
155048 |
56317840 |
2 |
SO2N3H8C10 |
AB2C3D8E10 |
59.96 |
3.36 |
-8.97 |
-1.93 |
0 |
|
|
155049 |
56320321 |
1 |
FO2N4H25C27 |
AB2C4D25E27 |
4.72 |
4.56 |
-8.87 |
-0.95 |
0 |
|
|
155050 |
56320466 |
1 |
FO2N5C26H30 |
AB2C5D26E30 |
-33.26 |
3.34 |
-7.89 |
-1.06 |
0 |
|
|
155051 |
56320467 |
1 |
FN4O4C24H27 |
AB4C4D24E27 |
-102.63 |
6.95 |
-8.4 |
-0.98 |
0 |
|
|
155052 |
56320468 |
1 |
FO2N4H25C27 |
AB2C4D25E27 |
2.81 |
2.68 |
-8.88 |
-1.06 |
0 |
|
|
155053 |
56320469 |
1 |
FN3O3H24C25 |
AB3C3D24E25 |
-64.25 |
7.03 |
-9.09 |
-0.99 |
0 |
|
|
155054 |
56320470 |
1 |
FO2N4C23H25 |
AB2C4D23E25 |
-37.83 |
2.26 |
-8.61 |
-1.09 |
0 |
|
|
155055 |
56320472 |
1 |
FO2N5H20C22 |
AB2C5D20E22 |
10.33 |
5.13 |
-9.36 |
-1.14 |
0 |
|
|
155056 |
56320473 |
1 |
FO3N5C24H26 |
AB3C5D24E26 |
-78.72 |
4.64 |
-8.86 |
-0.91 |
0 |
|
|
155057 |
56320474 |
1 |
FO2N4C25H29 |
AB2C4D25E29 |
-47.36 |
6.57 |
-9.34 |
-0.98 |
0 |
|
|
155058 |
56320475 |
1 |
BrFO2N4C22H22 |
ABC2D4E22F22 |
-26.83 |
6.67 |
-8.96 |
-1.02 |
0 |
|
|
155059 |
56320629 |
1 |
SCl2N4O5C16H18 |
AB2C4D5E16F18 |
-173.32 |
11.99 |
-9.1 |
-0.52 |
0 |
|
|
155060 |
56320630 |
1 |
SN4O5C16H26 |
AB4C5D16E26 |
-205.81 |
9.78 |
-9.29 |
0.03 |
0 |
|
|
155061 |
56320631 |
1 |
SN4O5C21H24 |
AB4C5D21E24 |
-147.74 |
11.97 |
-8.35 |
-0.38 |
0 |
|
|
155062 |
56320632 |
1 |
SN4O5C18H30 |
AB4C5D18E30 |
-218.0 |
8.77 |
-9.76 |
-0.02 |
0 |
|
|
155063 |
56320634 |
1 |
SN3O7C18H23 |
AB3C7D18E23 |
-233.66 |
13.2 |
-9.44 |
-0.58 |
0 |
|
|
155064 |
56320635 |
1 |
SO4N7C14H23 |
AB4C7D14E23 |
-82.54 |
14.11 |
-9.83 |
-0.45 |
0 |
|
|
155065 |
56320636 |
1 |
ClSN4O5C17H21 |
ABC4D5E17F21 |
-176.53 |
9.78 |
-8.82 |
-0.25 |
0 |
|
|
155066 |
56320637 |
1 |
BrClN3O3H15C17 |
ABC3D3E15F17 |
-62.8 |
3.75 |
-9.29 |
-1.64 |
0 |
|
|
155067 |
56320638 |
1 |
BrClFO2N3C18H18 |
ABCD2E3F18G18 |
-80.53 |
4.8 |
-9.08 |
-1.53 |
0 |
|
|
155068 |
56320641 |
1 |
O2N4C25H28 |
A2B4C25D28 |
-1.18 |
3.62 |
-8.57 |
-0.13 |
0 |
|
|
155069 |
56320642 |
1 |
OCl2N4H16C18 |
AB2C4D16E18 |
25.83 |
6.78 |
-8.82 |
-0.69 |
0 |
|
|
155070 |
56320643 |
1 |
O2F3N5C23H24 |
A2B3C5D23E24 |
-155.98 |
8.3 |
-8.96 |
-0.73 |
0 |
|
|
155071 |
56320644 |
1 |
O2F3N5C24H30 |
A2B3C5D24E30 |
-196.26 |
5.65 |
-9.13 |
-0.7 |
0 |
|
|
155072 |
56320646 |
1 |
ON4C21H24 |
AB4C21D24 |
25.97 |
3.31 |
-8.7 |
-0.49 |
0 |
|
|
155073 |
56320647 |
1 |
O3N4C25H32 |
A3B4C25D32 |
-92.85 |
3.4 |
-8.29 |
-0.15 |
0 |
|
|
155074 |
56320648 |
1 |
OSF3N4H19C20 |
ABC3D4E19F20 |
-121.5 |
1.5 |
-8.95 |
-0.69 |
0 |
|
|
155075 |
56320649 |
1 |
O2N5C24H33 |
A2B5C24D33 |
-69.55 |
1.84 |
-8.81 |
-0.18 |
0 |
|
|
155076 |
56320650 |
1 |
O3N5C23H31 |
A3B5C23D31 |
-88.73 |
2.95 |
-8.62 |
-0.18 |
0 |
|
|
155077 |
56320653 |
1 |
SO3N5C22H25 |
AB3C5D22E25 |
-14.34 |
10.06 |
-9.24 |
-0.74 |
0 |
|
|
155078 |
56320654 |
1 |
SO3N5C23H31 |
AB3C5D23E31 |
-64.5 |
6.57 |
-9.31 |
-0.6 |
0 |
|
|
155079 |
56320655 |
1 |
O3N4C25H30 |
A3B4C25D30 |
-51.64 |
6.04 |
-8.72 |
-0.68 |
0 |
|
|
155080 |
56320660 |
1 |
N4O5C27H38 |
A4B5C27D38 |
-188.71 |
2.77 |
-8.64 |
0.2 |
0 |
|
|
155081 |
56320661 |
1 |
ClN2O3C19H19 |
AB2C3D19E19 |
-49.57 |
4.21 |
-9.07 |
-0.9 |
0 |
|
|
155082 |
56320662 |
1 |
SN2O2F3H15C18 |
AB2C2D3E15F18 |
-156.22 |
2.77 |
-9.01 |
-1.44 |
0 |
|
|
155083 |
56320663 |
1 |
INO4C18H20 |
ABC4D18E20 |
-90.95 |
5.32 |
-8.65 |
-0.87 |
0 |
|
|
155084 |
56320664 |
1 |
INO3C19H22 |
ABC3D19E22 |
-64.94 |
5.58 |
-8.72 |
-0.93 |
0 |
|
|
155085 |
56320668 |
1 |
INO5C19H20 |
ABC5D19E20 |
-132.94 |
5.23 |
-8.66 |
-0.97 |
0 |
|
|
155086 |
56320669 |
1 |
ClN2O2C17H19 |
AB2C2D17E19 |
-30.07 |
6.21 |
-9.08 |
-1.01 |
0 |
|
|
155087 |
56320670 |
1 |
OSN2F3H15C16 |
ABC2D3E15F16 |
-136.37 |
2.95 |
-9.66 |
-1.54 |
0 |
|
|
155088 |
56320673 |
1 |
ISN3O3C16H18 |
ABC3D3E16F18 |
-32.37 |
5.0 |
-8.82 |
-1.13 |
0 |