List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
313405 |
126614460 |
1 |
ON4H30C36 |
AB4C30D36 |
132.61 |
4.87 |
-8.17 |
-0.53 |
0 |
|
|
313406 |
126614475 |
1 |
SN3H37C46 |
AB3C37D46 |
169.1 |
2.56 |
-8.02 |
-0.74 |
0 |
|
|
313407 |
126614511 |
1 |
SN3H29C43 |
AB3C29D43 |
204.72 |
3.15 |
-8.1 |
-0.95 |
0 |
|
|
313408 |
126614522 |
1 |
ON4H30C42 |
AB4C30D42 |
224.73 |
5.94 |
-8.52 |
-1.0 |
0 |
|
|
313409 |
126614524 |
1 |
NO2C25H25 |
AB2C25D25 |
-11.51 |
3.15 |
-8.06 |
0.05 |
0 |
|
|
313410 |
126614528 |
1 |
NOH47C59 |
ABC47D59 |
129.98 |
1.35 |
-7.68 |
-0.67 |
0 |
|
|
313411 |
126614536 |
1 |
NO3H33C54 |
AB3C33D54 |
143.22 |
1.52 |
-7.73 |
-0.74 |
0 |
|
|
313412 |
126614554 |
1 |
SN4H34C42 |
AB4C34D42 |
192.89 |
4.45 |
-8.06 |
-0.66 |
0 |
|
|
313413 |
126614561 |
1 |
SN4H26C40 |
AB4C26D40 |
211.32 |
1.47 |
-8.19 |
-1.24 |
0 |
|
|
313414 |
126614567 |
1 |
O14N21C66H111 |
A14B21C66D111 |
-551.0 |
1.68 |
-8.64 |
-0.41 |
0 |
|
|
313415 |
126614581 |
1 |
N2H26C31 |
A2B26C31 |
137.14 |
0.64 |
-7.57 |
-0.39 |
0 |
|
|
313416 |
126614586 |
1 |
NO2C27H29 |
AB2C27D29 |
-10.81 |
2.66 |
-7.7 |
0.28 |
0 |
|
|
313417 |
126614601 |
1 |
ClN3O4H24C25 |
AB3C4D24E25 |
-12.29 |
4.15 |
-8.13 |
-1.69 |
0 |
|
|
313418 |
126614625 |
1 |
S2N15O20C100H137 |
A2B15C20D100E137 |
-846.02 |
11.17 |
-8.64 |
-0.24 |
0 |
|
|
313419 |
126614626 |
1 |
SO12N13C50H77 |
AB12C13D50E77 |
-522.11 |
6.8 |
-8.44 |
-0.21 |
0 |
|
|
313420 |
126614627 |
1 |
N10O15C77H98 |
A10B15C77D98 |
-499.97 |
6.11 |
-8.67 |
-0.32 |
0 |
|
|
313421 |
126614628 |
1 |
N2O5C22H26 |
A2B5C22D26 |
-164.17 |
1.24 |
-8.8 |
-0.35 |
0 |
|
|
313422 |
126614637 |
2 |
Cl3N3O4C19H19 |
A3B3C4D19E19 |
-261.32 |
4.77 |
-8.42 |
-1.45 |
0 |
|
|
313423 |
126614644 |
2 |
Cl2O2N4C19H19 |
A2B2C4D19E19 |
-10.61 |
5.09 |
-8.89 |
-1.15 |
0 |
|
|
313424 |
126614658 |
1 |
N2O3H16C18 |
A2B3C16D18 |
-51.42 |
4.21 |
-8.67 |
-0.71 |
0 |
|
|
313425 |
126614685 |
1 |
N2O3H12C17 |
A2B3C12D17 |
93.71 |
3.25 |
-8.98 |
-1.03 |
0 |
|
|
313426 |
126614698 |
1 |
PN5O8H38C42 |
AB5C8D38E42 |
-80.74 |
8.35 |
-8.4 |
-1.54 |
0 |
|
|
313427 |
126614701 |
2 |
Cl2N4O4C19H19 |
A2B4C4D19E19 |
-169.08 |
9.56 |
-8.73 |
-1.17 |
0 |
|
|
313428 |
126614703 |
2 |
Cl3N4O4H18C19 |
A3B4C4D18E19 |
-184.01 |
4.53 |
-8.88 |
-1.32 |
0 |
|
|
313429 |
126614704 |
1 |
Cl4O4N7C42H53 |
A4B4C7D42E53 |
-101.35 |
9.52 |
-8.06 |
-1.11 |
0 |
|
|
313430 |
126614706 |
2 |
NO2H12C13 |
AB2C12D13 |
-78.86 |
6.12 |
-8.14 |
-0.4 |
0 |
|
|
313432 |
126614712 |
2 |
NC8H14 |
AB8C14 |
-28.54 |
2.88 |
-9.2 |
3.26 |
0 |
|
|
313433 |
126614715 |
2 |
NO2C9H18 |
AB2C9D18 |
-212.41 |
2.05 |
-9.06 |
1.71 |
0 |
|
|
313434 |
126614718 |
4 |
NH2C3 |
AB2C3 |
150.08 |
11.14 |
-8.77 |
-2.31 |
0 |
|
|
313435 |
126614719 |
1 |
O4C15H18 |
A4B15C18 |
-170.75 |
2.16 |
-10.11 |
-0.12 |
0 |
|
|
313436 |
126614720 |
1 |
N2C11H22 |
A2B11C22 |
-33.91 |
3.01 |
-8.9 |
2.91 |
0 |
|
|
313437 |
126614722 |
2 |
Cl3N3O4H16C17 |
A3B3C4D16E17 |
-251.75 |
4.31 |
-8.51 |
-1.4 |
0 |
|
|
313438 |
126614723 |
1 |
Cl4N7O8H23C30 |
A4B7C8D23E30 |
-179.79 |
7.27 |
-9.07 |
-1.57 |
0 |
|
|
313440 |
126614729 |
2 |
N2O6C31H47 |
A2B6C31D47 |
-526.05 |
7.07 |
-8.4 |
-0.98 |
0 |
|
|
313441 |
126614736 |
1 |
N4O4C11H16 |
A4B4C11D16 |
-139.15 |
1.23 |
-8.8 |
-0.41 |
0 |
|
|
313442 |
126614766 |
1 |
O3C13H26 |
A3B13C26 |
-174.75 |
3.33 |
-9.72 |
1.6 |
0 |
|
|
313443 |
126614776 |
1 |
IOC11H15 |
ABC11D15 |
-34.08 |
3.82 |
-9.23 |
-0.75 |
0 |
|
|
313444 |
126614785 |
1 |
IN2C7H15 |
AB2C7D15 |
16.55 |
2.42 |
-8.23 |
-1.78 |
0 |
|
|
313445 |
126614789 |
1 |
O2F3N9C32H36 |
A2B3C9D32E36 |
-92.06 |
4.52 |
-9.02 |
-1.06 |
0 |
|
|
313446 |
126614791 |
2 |
NC4H7 |
AB4C7 |
45.62 |
2.07 |
-7.51 |
0.4 |
0 |
|
|
313447 |
126614792 |
1 |
NC21H35 |
AB21C35 |
-29.66 |
1.1 |
-8.63 |
0.61 |
0 |
|
|
313448 |
126614793 |
1 |
O3N10C23H28 |
A3B10C23D28 |
-24.28 |
2.32 |
-8.54 |
-0.74 |
0 |
|
|
313449 |
126614796 |
1 |
O10C49H96 |
A10B49C96 |
-657.96 |
4.16 |
-9.44 |
1.02 |
0 |
|
|
313450 |
126614804 |
1 |
O3C5H10 |
A3B5C10 |
-144.92 |
2.92 |
-10.02 |
1.53 |
0 |
|
|
313451 |
126614806 |
1 |
O2C13H26 |
A2B13C26 |
-131.48 |
2.28 |
-9.66 |
1.82 |
0 |
|
|
313452 |
126614811 |
1 |
O3C8H14 |
A3B8C14 |
-126.99 |
3.57 |
-9.98 |
1.6 |
0 |
|
|
313453 |
126614813 |
1 |
O3C13H24 |
A3B13C24 |
-148.67 |
4.43 |
-8.46 |
1.11 |
0 |
|
|
313454 |
126614815 |
2 |
NSO7C20H42 |
ABC7D20E42 |
-721.61 |
5.38 |
-9.04 |
-0.08 |
0 |
|
|
313455 |
126614820 |
1 |
O2C17H32 |
A2B17C32 |
-128.17 |
3.21 |
-9.38 |
2.15 |
0 |
|
|
313456 |
126614828 |
1 |
ClSN2O3C21H23 |
ABC2D3E21F23 |
-69.14 |
9.39 |
-8.7 |
-0.83 |
0 |
|
|
313457 |
126614834 |
1 |
IOSC7H7 |
ABCD7E7 |
2.49 |
3.55 |
-9.38 |
-1.44 |
0 |
|
|
313458 |
126614835 |
1 |
SN2O4C22H26 |
AB2C4D22E26 |
-96.27 |
4.54 |
-8.23 |
-0.33 |
0 |
|
|
313459 |
126614837 |
1 |
ON3C19H31 |
AB3C19D31 |
13.56 |
2.62 |
-8.87 |
-0.07 |
0 |
|
|
313460 |
126614842 |
1 |
SN2O5C25H30 |
AB2C5D25E30 |
-163.76 |
6.58 |
-8.74 |
-0.34 |
0 |
|
|
313461 |
126614877 |
1 |
NC16H17 |
AB16C17 |
62.18 |
1.21 |
-8.04 |
-0.23 |
0 |
|
|
313462 |
126614879 |
1 |
ClSN2O4H17C23 |
ABC2D4E17F23 |
-89.54 |
5.77 |
-8.94 |
-1.68 |
0 |
|
|
313463 |
126614881 |
1 |
ClSN2O4H19C24 |
ABC2D4E19F24 |
-91.45 |
6.67 |
-8.72 |
-1.59 |
0 |
|
|
313464 |
126614884 |
1 |
SO2N3C26H27 |
AB2C3D26E27 |
-18.35 |
7.68 |
-8.59 |
-1.0 |
0 |
|
|
313465 |
126614885 |
1 |
SN2O2C26H26 |
AB2C2D26E26 |
-24.27 |
10.21 |
-8.5 |
-0.92 |
0 |
|
|
313466 |
126614889 |
1 |
ClSN2O2H21C23 |
ABC2D2E21F23 |
-28.66 |
5.72 |
-8.41 |
-0.76 |
0 |
|
|
313467 |
126614892 |
1 |
ClSN2O2H19C23 |
ABC2D2E19F23 |
-19.35 |
7.45 |
-8.68 |
-0.95 |
0 |
|
|
313468 |
126614898 |
1 |
ClN2S2O5H17C20 |
AB2C2D5E17F20 |
-149.83 |
2.91 |
-9.22 |
-1.68 |
0 |
|
|
313469 |
126614899 |
1 |
ClFNS2O3H11C13 |
ABCD2E3F11G13 |
-137.79 |
6.81 |
-9.25 |
-0.94 |
0 |
|
|
313470 |
126614900 |
1 |
N2O3S3C16H22 |
A2B3C3D16E22 |
-95.72 |
2.61 |
-8.77 |
-1.25 |
0 |
|
|
313471 |
126614901 |
1 |
NS2O5H15C16 |
AB2C5D15E16 |
-118.98 |
5.75 |
-8.74 |
-1.68 |
0 |
|
|
313472 |
126614902 |
1 |
N2S2O3H10C13 |
A2B2C3D10E13 |
-32.06 |
4.53 |
-9.28 |
-1.8 |
0 |
|
|
313473 |
126614913 |
1 |
ClFNO4H19C23 |
ABCD4E19F23 |
-136.53 |
4.42 |
-8.56 |
-0.64 |
0 |
|
|
313474 |
126614916 |
1 |
N2S2O5H20C21 |
A2B2C5D20E21 |
-136.41 |
10.26 |
-8.9 |
-1.64 |
0 |
|
|
313475 |
126614917 |
1 |
N2S2O7H18C21 |
A2B2C7D18E21 |
-207.82 |
6.16 |
-9.01 |
-1.24 |
0 |
|
|
313476 |
126614918 |
1 |
NO5H21C23 |
AB5C21D23 |
-126.57 |
3.34 |
-8.46 |
-0.38 |
0 |
|
|
313477 |
126614932 |
1 |
BrNSO3H20C23 |
ABCD3E20F23 |
-45.14 |
1.52 |
-8.67 |
-0.7 |
0 |
|
|
313478 |
126614950 |
1 |
SN2O4H22C25 |
AB2C4D22E25 |
-92.62 |
7.12 |
-8.66 |
-1.12 |
0 |
|
|
313479 |
126614954 |
2 |
NOC6H12 |
ABC6D12 |
-108.28 |
3.99 |
-9.19 |
1.2 |
0 |
|
|
313480 |
126614959 |
1 |
NO2C16H29 |
AB2C16D29 |
-88.17 |
3.12 |
-9.26 |
-0.22 |
0 |
|
|
313481 |
126614966 |
1 |
NO5C16H25 |
AB5C16D25 |
-221.67 |
3.97 |
-8.96 |
0.17 |
0 |