List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
197495 |
78970994 |
1 |
NO5C12H13 |
AB5C12D13 |
-179.61 |
4.23 |
-9.54 |
-0.84 |
0 |
|
|
197496 |
78970995 |
1 |
NOSBr2C11H15 |
ABCD2E11F15 |
-29.2 |
3.86 |
-9.66 |
-1.28 |
0 |
|
|
197497 |
78971156 |
1 |
NO2C13H15 |
AB2C13D15 |
-33.49 |
3.13 |
-9.03 |
-0.3 |
0 |
|
|
197498 |
78971214 |
1 |
N2O4C13H18 |
A2B4C13D18 |
-152.61 |
1.6 |
-9.36 |
0.31 |
0 |
|
|
197499 |
78971215 |
1 |
N2O4C11H16 |
A2B4C11D16 |
-154.68 |
5.73 |
-9.73 |
-0.19 |
0 |
|
|
197500 |
78971350 |
1 |
N2O3C14H20 |
A2B3C14D20 |
-122.1 |
4.48 |
-9.74 |
0.26 |
0 |
|
|
197501 |
78971759 |
1 |
NOC12H21 |
ABC12D21 |
-68.62 |
3.33 |
-9.48 |
0.28 |
0 |
|
|
197502 |
78971920 |
1 |
N2O3C11H14 |
A2B3C11D14 |
-115.35 |
4.4 |
-9.66 |
-0.81 |
0 |
|
|
197503 |
78972036 |
1 |
FN3O3C9H10 |
AB3C3D9E10 |
-78.98 |
2.26 |
-9.76 |
-1.83 |
0 |
|
|
197504 |
78972354 |
1 |
N3O3C9H17 |
A3B3C9D17 |
-144.7 |
2.95 |
-9.32 |
0.2 |
0 |
|
|
197505 |
78972355 |
1 |
N3O3C10H13 |
A3B3C10D13 |
-109.48 |
6.4 |
-8.89 |
-0.23 |
0 |
|
|
197506 |
78972551 |
1 |
BrFON2C9H10 |
ABCD2E9F10 |
-66.43 |
2.56 |
-9.35 |
-0.65 |
0 |
|
|
197507 |
78972712 |
1 |
OF3N3C12H22 |
AB3C3D12E22 |
-227.44 |
4.42 |
-9.04 |
0.76 |
0 |
|
|
197508 |
78972823 |
1 |
BrINO3H9C10 |
ABCD3E9F10 |
-89.36 |
6.4 |
-10.02 |
-1.73 |
0 |
|
|
197509 |
78972861 |
1 |
NO2C9H17 |
AB2C9D17 |
-96.38 |
3.8 |
-9.58 |
0.18 |
0 |
|
|
197510 |
78973148 |
1 |
ON2C10H22 |
AB2C10D22 |
-81.27 |
4.32 |
-9.27 |
1.18 |
0 |
|
|
197511 |
78973985 |
1 |
ClSO2H9C12 |
ABC2D9E12 |
-50.86 |
6.23 |
-9.52 |
-1.13 |
0 |
|
|
197512 |
78973986 |
1 |
SO2F3H9C13 |
AB2C3D9E13 |
-204.23 |
5.07 |
-9.74 |
-1.49 |
0 |
|
|
197513 |
78973987 |
1 |
BrSN2C12H13 |
ABC2D12E13 |
57.28 |
4.85 |
-9.13 |
-0.46 |
0 |
|
|
197514 |
78974242 |
1 |
BrNOC16H22 |
ABCD16E22 |
-8.82 |
1.4 |
-8.78 |
-0.94 |
0 |
|
|
197515 |
78974243 |
1 |
ClNOC16H22 |
ABCD16E22 |
-20.42 |
2.77 |
-8.77 |
-0.86 |
0 |
|
|
197516 |
78974244 |
1 |
NOF2C16H21 |
ABC2D16E21 |
-105.51 |
3.27 |
-8.72 |
-0.78 |
0 |
|
|
197517 |
78974321 |
2 |
NC9H13 |
AB9C13 |
59.76 |
3.45 |
-8.88 |
-0.1 |
0 |
|
|
197518 |
78974322 |
1 |
N2C15H20 |
A2B15C20 |
53.33 |
4.65 |
-8.41 |
-0.27 |
0 |
|
|
197519 |
78974323 |
1 |
FN2C15H19 |
AB2C15D19 |
7.82 |
6.28 |
-8.69 |
-0.64 |
0 |
|
|
197520 |
78974324 |
1 |
NO2C16H23 |
AB2C16D23 |
-75.38 |
3.96 |
-9.09 |
0.13 |
0 |
|
|
197521 |
78974325 |
2 |
NOC7H10 |
ABC7D10 |
-55.95 |
7.76 |
-9.0 |
-0.79 |
0 |
|
|
197522 |
78974326 |
1 |
N2C13H28 |
A2B13C28 |
-21.14 |
1.09 |
-8.64 |
2.56 |
0 |
|
|
197523 |
78974327 |
2 |
NC9H14 |
AB9C14 |
10.71 |
3.01 |
-8.21 |
0.45 |
0 |
|
|
197524 |
78974490 |
1 |
SN2O2C14H28 |
AB2C2D14E28 |
-96.26 |
5.41 |
-9.16 |
0.42 |
0 |
|
|
197525 |
78974696 |
1 |
SN2C17H30 |
AB2C17D30 |
7.21 |
1.66 |
-8.46 |
-0.04 |
0 |
|
|
197526 |
78974697 |
1 |
N2O2C13H16 |
A2B2C13D16 |
-37.34 |
3.83 |
-9.23 |
-0.61 |
0 |
|
|
197527 |
78974698 |
1 |
ON2C12H12 |
AB2C12D12 |
22.02 |
4.35 |
-9.29 |
-0.87 |
0 |
|
|
197528 |
78974699 |
1 |
ON2H16C18 |
AB2C16D18 |
55.51 |
4.9 |
-9.24 |
-0.63 |
0 |
|
|
197529 |
78974700 |
1 |
FN2C17H27 |
AB2C17D27 |
-29.84 |
2.54 |
-8.5 |
0.27 |
0 |
|
|
197530 |
78974701 |
1 |
OSN2H14C17 |
ABC2D14E17 |
40.1 |
6.7 |
-8.78 |
-0.7 |
0 |
|
|
197531 |
78974702 |
1 |
SN2C15H26 |
AB2C15D26 |
23.59 |
3.48 |
-8.51 |
0.22 |
0 |
|
|
197532 |
78974703 |
1 |
SN2C16H28 |
AB2C16D28 |
18.98 |
1.19 |
-8.61 |
-0.12 |
0 |
|
|
197533 |
78974803 |
1 |
O2N3C13H23 |
A2B3C13D23 |
-51.44 |
1.36 |
-9.06 |
0.15 |
0 |
|
|
197534 |
78974869 |
1 |
N3O3C9H11 |
A3B3C9D11 |
-66.58 |
2.97 |
-9.7 |
-1.56 |
0 |
|
|
197535 |
78975158 |
1 |
OF3N3C13H18 |
AB3C3D13E18 |
-202.28 |
5.9 |
-8.91 |
0.43 |
0 |
|
|
197536 |
78975159 |
1 |
ON4C13H20 |
AB4C13D20 |
-19.78 |
7.19 |
-8.71 |
0.1 |
0 |
|
|
197537 |
78975209 |
1 |
ClO3H13C15 |
AB3C13D15 |
-92.68 |
7.96 |
-9.68 |
-0.87 |
0 |
|
|
197538 |
78975210 |
1 |
ClNO4C13H16 |
ABC4D13E16 |
-170.02 |
3.88 |
-10.06 |
-1.25 |
0 |
|
|
197539 |
78975622 |
1 |
NSO3C14H19 |
ABC3D14E19 |
-121.26 |
7.53 |
-9.34 |
-1.26 |
0 |
|
|
197540 |
78975623 |
1 |
N2O4C13H24 |
A2B4C13D24 |
-220.56 |
8.13 |
-10.16 |
0.09 |
0 |
|
|
197541 |
78976091 |
1 |
N3O4C14H25 |
A3B4C14D25 |
-203.83 |
8.28 |
-9.6 |
0.28 |
0 |
|
|
197542 |
78976092 |
1 |
N2O5C14H28 |
A2B5C14D28 |
-243.99 |
9.05 |
-9.59 |
0.43 |
0 |
|
|
197543 |
78976093 |
1 |
N3O4C14H27 |
A3B4C14D27 |
-209.1 |
8.86 |
-9.7 |
0.02 |
0 |
|
|
197544 |
78976169 |
1 |
N3O4C12H23 |
A3B4C12D23 |
-213.71 |
8.7 |
-9.82 |
-0.05 |
0 |