List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
229423 |
87567610 |
4 |
NOH4C5 |
ABC4D5 |
-6.13 |
6.49 |
-8.65 |
-1.73 |
0 |
|
|
229424 |
87567621 |
1 |
SF3N4O5C16H21 |
AB3C4D5E16F21 |
-316.19 |
3.94 |
-9.06 |
-0.37 |
0 |
|
|
229425 |
87567623 |
1 |
CoC3H4O5 |
AB3C4D5 |
-185.7 |
7.03 |
0.0 |
0.0 |
0 |
|
|
229426 |
87567624 |
1 |
NO2C18H31 |
AB2C18D31 |
-125.95 |
4.95 |
-9.65 |
0.47 |
0 |
|
|
229427 |
87567626 |
1 |
O5C10H22 |
A5B10C22 |
-263.95 |
3.2 |
-10.56 |
0.8 |
0 |
|
|
229428 |
87567629 |
1 |
OSN3C12H15 |
ABC3D12E15 |
9.95 |
3.44 |
-9.03 |
-0.82 |
0 |
|
|
229429 |
87567631 |
1 |
O4N7C28H35 |
A4B7C28D35 |
-61.38 |
2.2 |
-8.04 |
-0.76 |
0 |
|
|
229430 |
87567633 |
1 |
O5C8H18 |
A5B8C18 |
-255.06 |
5.85 |
-10.24 |
0.72 |
0 |
|
|
229431 |
87567635 |
1 |
S2Cl4N4O5H12C22 |
A2B4C4D5E12F22 |
-79.62 |
12.1 |
-9.34 |
-2.6 |
0 |
|
|
229432 |
87567636 |
1 |
ClON3H12C13 |
ABC3D12E13 |
31.42 |
2.18 |
-9.63 |
-1.04 |
0 |
|
|
229433 |
87567637 |
1 |
S4N6O17C64H70 |
A4B6C17D64E70 |
-505.92 |
8.29 |
-8.72 |
-1.14 |
0 |
|
|
229434 |
87567639 |
1 |
ClSO2N5C22H24 |
ABC2D5E22F24 |
-31.73 |
6.26 |
-8.76 |
-0.79 |
0 |
|
|
229435 |
87567640 |
1 |
NOS2C6H9 |
ABC2D6E9 |
-42.02 |
2.71 |
-8.98 |
-0.2 |
0 |
|
|
229436 |
87567647 |
1 |
FSN3O3C25H30 |
ABC3D3E25F30 |
-88.78 |
4.71 |
-9.01 |
-0.13 |
0 |
|
|
229437 |
87567649 |
1 |
O7C8H16 |
A7B8C16 |
-330.89 |
7.5 |
-10.48 |
0.02 |
-1 |
|
|
229438 |
87567651 |
1 |
N11O16C78H124 |
A11B16C78D124 |
-761.36 |
6.76 |
0.0 |
0.0 |
0 |
|
|
229439 |
87567655 |
1 |
SN3O6C26H39 |
AB3C6D26E39 |
-240.01 |
3.62 |
-8.73 |
-0.57 |
0 |
|
|
229440 |
87567663 |
1 |
PSF2N3O6C36H44 |
ABC2D3E6F36G44 |
-354.61 |
5.21 |
-8.97 |
-1.08 |
0 |
|
|
229441 |
87567673 |
1 |
BrPO6C12H16 |
ABC6D12E16 |
-287.41 |
4.39 |
-9.1 |
-0.67 |
0 |
|
|
229442 |
87567675 |
1 |
N2O5C7H14 |
A2B5C7D14 |
-183.88 |
6.54 |
-9.8 |
-0.54 |
0 |
|
|
229443 |
87567676 |
1 |
ClFSN3O4C21H21 |
ABCD3E4F21G21 |
-151.9 |
6.6 |
-9.2 |
-1.1 |
0 |
|
|
229444 |
87567677 |
1 |
N11O14C62H113 |
A11B14C62D113 |
-757.58 |
7.26 |
-9.24 |
0.2 |
0 |
|
|
229445 |
87567678 |
1 |
SN3O4F6H17C20 |
AB3C4D6E17F20 |
-434.81 |
4.08 |
-9.9 |
-1.41 |
0 |
|
|
229446 |
87567680 |
1 |
FSO3N5C20H22 |
ABC3D5E20F22 |
-33.43 |
4.38 |
-9.19 |
-1.28 |
0 |
|
|
229447 |
87567682 |
1 |
SN5O5H21C22 |
AB5C5D21E22 |
-70.61 |
6.52 |
-9.28 |
-1.15 |
0 |
|
|
229448 |
87567685 |
1 |
BrNOC9H18 |
ABCD9E18 |
-58.22 |
10.9 |
-8.07 |
-0.33 |
0 |
|
|
229449 |
87567689 |
1 |
FOSCl2N2C22H25 |
ABCD2E2F22G25 |
-71.1 |
4.27 |
-9.22 |
-0.71 |
0 |
|
|
229450 |
87567691 |
1 |
NSO5C14H29 |
ABC5D14E29 |
-232.92 |
14.35 |
-9.75 |
-0.45 |
0 |
|
|
229451 |
87567692 |
1 |
BrPF2O4C12H16 |
ABC2D4E12F16 |
-324.14 |
5.11 |
-9.86 |
-0.77 |
0 |
|
|
229452 |
87567699 |
1 |
NOC13H23 |
ABC13D23 |
-58.57 |
4.06 |
-9.18 |
-0.21 |
0 |
|
|
229453 |
87567700 |
1 |
ClFN3O4H23C27 |
ABC3D4E23F27 |
-88.02 |
6.18 |
-9.61 |
-1.1 |
0 |
|
|
229454 |
87567701 |
1 |
NO5H15C16 |
AB5C15D16 |
-164.53 |
7.13 |
-8.8 |
-0.95 |
0 |
|
|
229455 |
87567702 |
1 |
FSO2N3C22H24 |
ABC2D3E22F24 |
-34.93 |
1.74 |
-9.01 |
-0.31 |
0 |
|
|
229456 |
87567703 |
1 |
NO5H15C16 |
AB5C15D16 |
-154.91 |
3.36 |
-9.29 |
-0.35 |
0 |
|
|
229457 |
87567706 |
1 |
SN2O3H18C19 |
AB2C3D18E19 |
4.47 |
3.53 |
-9.35 |
-1.25 |
0 |
|
|
229458 |
87567709 |
1 |
SiO2C9H18 |
AB2C9D18 |
-124.51 |
2.32 |
-9.31 |
1.14 |
0 |
|
|
229459 |
87567710 |
1 |
SiO3C10H19 |
AB3C10D19 |
-158.92 |
4.16 |
0.0 |
0.0 |
0 |
|
|
229460 |
87567711 |
2 |
KO2C11H18 |
AB2C11D18 |
-310.59 |
10.94 |
-8.38 |
0.36 |
0 |
|
|
229461 |
87567716 |
1 |
FNOS2C21H22 |
ABCD2E21F22 |
1.05 |
2.94 |
-8.87 |
-0.24 |
0 |
|
|
229462 |
87567721 |
1 |
BrPF2O4C12H16 |
ABC2D4E12F16 |
-317.64 |
2.34 |
-9.06 |
-0.5 |
0 |
|
|
229463 |
87567728 |
1 |
ON6C23H26 |
AB6C23D26 |
50.5 |
11.42 |
-8.09 |
-1.19 |
0 |
|
|
229464 |
87567730 |
1 |
PSF2N4O7C29H35 |
ABC2D4E7F29G35 |
-382.89 |
7.14 |
-9.37 |
-0.92 |
0 |
|
|
229465 |
87567732 |
1 |
SF3N3O5C17H22 |
AB3C3D5E17F22 |
-324.9 |
3.86 |
-9.1 |
-1.04 |
0 |
|
|
229466 |
87567739 |
1 |
NO3C13H15 |
AB3C13D15 |
-61.76 |
13.07 |
-8.76 |
-1.28 |
0 |
|
|
229467 |
87567747 |
1 |
O8C9H18 |
A8B9C18 |
-367.33 |
5.86 |
-10.14 |
-0.35 |
0 |
|
|
229468 |
87567748 |
1 |
ClFOS2N3C19H21 |
ABCD2E3F19G21 |
-5.11 |
3.51 |
-9.08 |
-1.08 |
0 |
|
|
229469 |
87567764 |
1 |
ClN2O7H29C32 |
AB2C7D29E32 |
-123.7 |
2.53 |
-8.5 |
-1.21 |
0 |
|
|
229470 |
87567767 |
1 |
BrN2O2C11H13 |
AB2C2D11E13 |
-72.88 |
5.86 |
-9.78 |
-0.77 |
0 |
|
|
229471 |
87567770 |
1 |
N2H46C71 |
A2B46C71 |
319.11 |
4.0 |
-8.02 |
-0.99 |
0 |
|
|
229472 |
87567772 |
1 |
SN4O4F6H22C23 |
AB4C4D6E22F23 |
-331.85 |
6.58 |
-9.88 |
-1.08 |
0 |