List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
268500 |
103599663 |
1 |
ON6C26H28 |
AB6C26D28 |
80.14 |
5.72 |
-8.75 |
-0.59 |
0 |
|
|
268501 |
103599664 |
1 |
SO2N5C23H25 |
AB2C5D23E25 |
27.35 |
7.23 |
-8.79 |
-0.91 |
0 |
|
|
268502 |
103599665 |
1 |
SO2N7H21C22 |
AB2C7D21E22 |
96.22 |
5.51 |
-9.15 |
-1.33 |
0 |
|
|
268503 |
103599669 |
1 |
SN3O4C21H27 |
AB3C4D21E27 |
-94.08 |
0.32 |
-8.89 |
-1.12 |
0 |
|
|
268504 |
103599670 |
1 |
SO3N4C21H28 |
AB3C4D21E28 |
-44.37 |
6.8 |
-8.99 |
-0.88 |
0 |
|
|
268505 |
103599672 |
1 |
SN3O3C22H35 |
AB3C3D22E35 |
-104.17 |
4.81 |
-8.8 |
-0.86 |
0 |
|
|
268506 |
103599674 |
1 |
SO3N4C21H34 |
AB3C4D21E34 |
-95.67 |
4.66 |
-8.33 |
-1.0 |
0 |
|
|
268507 |
103599677 |
1 |
O2N6C23H24 |
A2B6C23D24 |
62.16 |
3.84 |
-8.49 |
-0.81 |
0 |
|
|
268508 |
103599678 |
1 |
ON7C23H23 |
AB7C23D23 |
115.15 |
3.38 |
-9.1 |
-1.02 |
0 |
|
|
268509 |
103599685 |
1 |
SO2N4C18H30 |
AB2C4D18E30 |
-39.09 |
1.23 |
-8.8 |
-0.12 |
0 |
|
|
268510 |
103599686 |
1 |
ClSO2N4C19H23 |
ABC2D4E19F23 |
-38.72 |
6.7 |
-9.01 |
-1.38 |
0 |
|
|
268511 |
103599689 |
1 |
N3O4H21C23 |
A3B4C21D23 |
-76.43 |
4.94 |
-8.82 |
-0.97 |
0 |
|
|
268512 |
103599700 |
1 |
O2N4C25H26 |
A2B4C25D26 |
2.49 |
5.52 |
-9.15 |
-0.46 |
0 |
|
|
268513 |
103599705 |
1 |
O2N5C24H25 |
A2B5C24D25 |
12.82 |
4.28 |
-9.29 |
-0.76 |
0 |
|
|
268514 |
103599706 |
1 |
ClO2N4C21H25 |
AB2C4D21E25 |
-45.15 |
1.45 |
-9.09 |
-0.41 |
0 |
|
|
268515 |
103599709 |
1 |
FSN2O3C22H25 |
ABC2D3E22F25 |
-89.75 |
4.86 |
-9.5 |
-1.0 |
0 |
|
|
268516 |
103599711 |
1 |
O3N4C24H34 |
A3B4C24D34 |
-107.67 |
4.16 |
-8.65 |
-0.46 |
0 |
|
|
268517 |
103599722 |
1 |
O2N5C25H29 |
A2B5C25D29 |
22.63 |
4.76 |
-8.93 |
-0.78 |
0 |
|
|
268518 |
103599741 |
1 |
ON5C26H39 |
AB5C26D39 |
-5.37 |
4.47 |
-8.53 |
-0.13 |
0 |
|
|
268519 |
103599742 |
1 |
ON5C24H33 |
AB5C24D33 |
24.31 |
2.73 |
-8.62 |
-0.7 |
0 |
|
|
268520 |
103599743 |
1 |
O2N3C25H27 |
A2B3C25D27 |
-18.11 |
6.74 |
-8.94 |
-0.1 |
0 |
|
|
268521 |
103599757 |
2 |
N2O2H11C12 |
A2B2C11D12 |
1.11 |
6.72 |
-8.76 |
-0.87 |
0 |
|
|
268522 |
103599758 |
1 |
ClSO2N3H18C23 |
ABC2D3E18F23 |
47.5 |
3.75 |
-8.33 |
-1.37 |
0 |
|
|
268523 |
103599768 |
1 |
O2N6C23H24 |
A2B6C23D24 |
48.05 |
3.05 |
-8.63 |
-0.9 |
0 |
|
|
268524 |
103599783 |
1 |
BrSO2N3C18H18 |
ABC2D3E18F18 |
5.66 |
5.34 |
-9.18 |
-0.9 |
0 |
|
|
268525 |
103599784 |
1 |
OSBr2N3H11C15 |
ABC2D3E11F15 |
71.56 |
3.39 |
-9.16 |
-1.15 |
0 |
|
|
268526 |
103599785 |
1 |
BrOS2N3C16H18 |
ABC2D3E16F18 |
37.92 |
1.55 |
-8.67 |
-0.99 |
0 |
|
|
268527 |
103599793 |
1 |
BrSN3O3C15H20 |
ABC3D3E15F20 |
-77.13 |
2.14 |
-8.82 |
-1.2 |
0 |
|
|
268528 |
103599794 |
1 |
BrClSO2N3H11C16 |
ABCD2E3F11G16 |
56.02 |
3.58 |
-9.48 |
-1.2 |
0 |
|
|
268529 |
103599798 |
1 |
ClSN3O3H18C19 |
ABC3D3E18F19 |
-50.04 |
7.22 |
-8.94 |
-1.34 |
0 |
|
|
268530 |
103599808 |
1 |
OCl2N5H15C20 |
AB2C5D15E20 |
86.0 |
3.98 |
-9.12 |
-1.14 |
0 |
|
|
268531 |
103599811 |
1 |
BrOSN4C19H23 |
ABCD4E19F23 |
36.18 |
2.5 |
-8.38 |
-1.17 |
0 |
|
|
268532 |
103599827 |
1 |
ClO2N6C22H31 |
AB2C6D22E31 |
-35.72 |
5.38 |
-8.63 |
-0.46 |
0 |
|
|
268533 |
103599828 |
1 |
ClO2N6C22H31 |
AB2C6D22E31 |
-33.73 |
4.38 |
-8.64 |
-0.43 |
0 |
|
|
268534 |
103599830 |
1 |
O2N5C26H31 |
A2B5C26D31 |
-9.17 |
5.69 |
-8.39 |
-0.4 |
0 |
|
|
268535 |
103599842 |
1 |
ClON5C22H22 |
ABC5D22E22 |
48.48 |
6.06 |
-8.78 |
-1.24 |
0 |
|
|
268536 |
103599843 |
1 |
ClN4O5H13C18 |
AB4C5D13E18 |
-36.79 |
9.93 |
-9.42 |
-1.61 |
0 |
|
|
268537 |
103599844 |
1 |
ClON5C22H22 |
ABC5D22E22 |
50.53 |
4.25 |
-8.87 |
-1.04 |
0 |
|
|
268538 |
103599846 |
1 |
ClO2N3C20H26 |
AB2C3D20E26 |
-53.94 |
4.32 |
-8.83 |
-0.46 |
0 |
|
|
268539 |
103599850 |
1 |
ClO2N3C20H26 |
AB2C3D20E26 |
-52.33 |
4.76 |
-8.85 |
-0.49 |
0 |
|
|
268540 |
103599852 |
2 |
ON2H12C13 |
AB2C12D13 |
45.12 |
7.64 |
-8.86 |
-0.96 |
0 |
|
|
268541 |
103599855 |
2 |
NOC8H10 |
ABC8D10 |
-79.17 |
3.26 |
-9.61 |
-0.05 |
0 |
|
|
268542 |
103599858 |
1 |
ClO2C18H19 |
AB2C18D19 |
-50.25 |
2.45 |
-8.74 |
-0.74 |
0 |
|
|
268543 |
103599865 |
1 |
NO2C16H25 |
AB2C16D25 |
-90.35 |
4.89 |
-8.48 |
0.48 |
0 |
|
|
268544 |
103599869 |
1 |
NO2C17H27 |
AB2C17D27 |
-103.93 |
3.54 |
-8.88 |
0.11 |
0 |
|
|
268545 |
103599870 |
1 |
NO2C15H21 |
AB2C15D21 |
-62.0 |
4.05 |
-8.92 |
0.06 |
0 |
|
|
268546 |
103599871 |
1 |
NO2C16H25 |
AB2C16D25 |
-99.15 |
3.53 |
-8.91 |
0.08 |
0 |
|
|
268547 |
103599875 |
1 |
NO2C18H27 |
AB2C18D27 |
-104.0 |
3.36 |
-8.82 |
0.15 |
0 |
|
|
268548 |
103599879 |
1 |
NO2C16H23 |
AB2C16D23 |
-70.61 |
3.36 |
-8.92 |
0.07 |
0 |
|
|
268549 |
103599881 |
1 |
ClO2C18H19 |
AB2C18D19 |
-48.17 |
3.55 |
-8.72 |
-0.96 |
0 |