List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
312661 |
126607220 |
1 |
O5C30H34 |
A5B30C34 |
-174.91 |
2.48 |
-8.77 |
0.08 |
0 |
|
|
312662 |
126607228 |
1 |
OPSF2H15C16 |
ABCD2E15F16 |
-87.82 |
5.39 |
-8.6 |
-0.32 |
0 |
|
|
312663 |
126607231 |
1 |
FO6C30H33 |
AB6C30D33 |
-260.23 |
1.5 |
-8.64 |
-0.11 |
0 |
|
|
312664 |
126607238 |
1 |
NC8H17 |
AB8C17 |
-1.43 |
1.79 |
-9.41 |
2.62 |
0 |
|
|
312665 |
126607243 |
1 |
OF3N5C23H26 |
AB3C5D23E26 |
-157.45 |
5.0 |
-8.97 |
-0.6 |
0 |
|
|
312666 |
126607244 |
1 |
NO3C28H41 |
AB3C28D41 |
-167.04 |
3.46 |
-8.69 |
0.27 |
0 |
|
|
312667 |
126607246 |
1 |
O2N4C23H28 |
A2B4C23D28 |
-40.37 |
1.55 |
-8.22 |
-0.17 |
0 |
|
|
312668 |
126607250 |
1 |
O2F3N4H21C22 |
A2B3C4D21E22 |
-163.08 |
7.97 |
-9.18 |
-1.44 |
0 |
|
|
312669 |
126607253 |
1 |
N4C17H24 |
A4B17C24 |
56.27 |
8.63 |
-8.73 |
-0.37 |
0 |
|
|
312670 |
126607256 |
1 |
FN3C24H30 |
AB3C24D30 |
-7.31 |
1.64 |
-8.73 |
-0.16 |
0 |
|
|
312671 |
126607258 |
1 |
ClNPO4C16H19 |
ABCD4E16F19 |
-219.49 |
3.55 |
-8.89 |
-0.6 |
0 |
|
|
312672 |
126607259 |
1 |
ClNPO4C24H29 |
ABCD4E24F29 |
-191.61 |
3.02 |
-9.4 |
-0.21 |
0 |
|
|
312673 |
126607261 |
1 |
ClIOF3H5C9 |
ABCD3E5F9 |
-161.55 |
3.39 |
-10.03 |
-1.79 |
0 |
|
|
312674 |
126607263 |
1 |
NC37H57 |
AB37C57 |
2.8 |
1.5 |
-7.85 |
-0.25 |
0 |
|
|
312675 |
126607264 |
1 |
OPSCl2F2H11C15 |
ABCD2E2F11G15 |
-84.48 |
5.08 |
-8.7 |
-1.03 |
0 |
|
|
312676 |
126607266 |
1 |
N3C16H25 |
A3B16C25 |
5.8 |
3.5 |
-8.62 |
0.07 |
0 |
|
|
312677 |
126607269 |
1 |
ClNPO3C17H21 |
ABCD3E17F21 |
-158.6 |
2.56 |
-8.93 |
-0.68 |
0 |
|
|
312678 |
126607288 |
1 |
OCl2N5C20H21 |
AB2C5D20E21 |
-2.73 |
8.31 |
-9.07 |
-0.47 |
0 |
|
|
312679 |
126607290 |
1 |
N3O3C26H31 |
A3B3C26D31 |
-37.69 |
6.12 |
-7.64 |
-0.61 |
0 |
|
|
312680 |
126607291 |
1 |
OSN5C24H27 |
ABC5D24E27 |
34.73 |
5.74 |
-8.44 |
-0.02 |
0 |
|
|
312681 |
126607293 |
1 |
N6C23H28 |
A6B23C28 |
118.34 |
2.34 |
-8.72 |
-0.95 |
0 |
|
|
312682 |
126607296 |
1 |
O3N4C15H18 |
A3B4C15D18 |
-86.11 |
3.4 |
-9.34 |
-0.74 |
0 |
|
|
312683 |
126607297 |
1 |
FN3C18H24 |
AB3C18D24 |
8.81 |
2.91 |
-8.12 |
-0.12 |
0 |
|
|
312684 |
126607306 |
3 |
NC5H7 |
AB5C7 |
19.65 |
3.22 |
-8.52 |
0.15 |
0 |
|
|
312685 |
126607338 |
2 |
N2C9H13 |
A2B9C13 |
43.62 |
7.74 |
-8.74 |
-0.44 |
0 |
|
|
312686 |
126607343 |
1 |
OF3N5C21H22 |
AB3C5D21E22 |
-147.15 |
10.09 |
-9.08 |
-0.51 |
0 |
|
|
312687 |
126607348 |
1 |
ClN3O3C26H32 |
AB3C3D26E32 |
-67.61 |
5.49 |
-7.87 |
-0.56 |
0 |
|
|
312688 |
126607375 |
2 |
NO2C31H34 |
AB2C31D34 |
-95.54 |
0.31 |
-9.02 |
-2.72 |
0 |
|
|
312689 |
126607378 |
1 |
FN5C20H24 |
AB5C20D24 |
67.92 |
5.83 |
-7.95 |
-0.3 |
0 |
|
|
312690 |
126607380 |
1 |
FOSN6H17C19 |
ABCD6E17F19 |
68.89 |
6.91 |
-8.35 |
-0.73 |
0 |
|
|
312691 |
126607386 |
1 |
NO5C7H11 |
AB5C7D11 |
-162.05 |
4.5 |
-10.44 |
-0.67 |
0 |
|
|
312692 |
126607402 |
1 |
NOSC10H13 |
ABCD10E13 |
65.91 |
4.01 |
-8.75 |
-0.59 |
0 |
|
|
312693 |
126607417 |
1 |
PN4O8C18H23 |
AB4C8D18E23 |
-328.02 |
0.88 |
-9.55 |
-1.54 |
0 |
|
|
312694 |
126607418 |
1 |
ClON3C14H16 |
ABC3D14E16 |
13.28 |
9.1 |
-7.94 |
-1.13 |
0 |
|
|
312695 |
126607441 |
1 |
N2O2C13H14 |
A2B2C13D14 |
-38.69 |
2.57 |
-9.44 |
-0.06 |
0 |
|
|
312696 |
126607445 |
1 |
ON5C19H25 |
AB5C19D25 |
3.47 |
3.04 |
-8.88 |
0.27 |
0 |
|
|
312697 |
126607450 |
1 |
O3N8C26H34 |
A3B8C26D34 |
-42.89 |
6.71 |
-8.8 |
-0.45 |
0 |
|
|
312698 |
126607451 |
1 |
ClON4C22H27 |
ABC4D22E27 |
-21.68 |
5.7 |
-9.04 |
-0.28 |
0 |
|
|
312699 |
126607452 |
1 |
ON5C22H29 |
AB5C22D29 |
-3.76 |
1.82 |
-8.87 |
-0.08 |
0 |
|
|
312700 |
126607456 |
1 |
OC10H16 |
AB10C16 |
-15.29 |
2.11 |
-9.08 |
0.66 |
0 |
|
|
312701 |
126607461 |
1 |
SO3C11H22 |
AB3C11D22 |
-178.48 |
2.3 |
-8.95 |
0.16 |
0 |
|
|
312702 |
126607463 |
1 |
O2N7C23H31 |
A2B7C23D31 |
-3.11 |
4.06 |
-8.26 |
-0.26 |
0 |
|
|
312703 |
126607465 |
1 |
BrN5O6C22H26 |
AB5C6D22E26 |
-133.54 |
3.54 |
-9.16 |
-1.6 |
0 |
|
|
312704 |
126607479 |
1 |
ON5C22H29 |
AB5C22D29 |
-12.23 |
4.72 |
-8.92 |
-0.15 |
0 |
|
|
312705 |
126607484 |
1 |
OC11H14 |
AB11C14 |
3.76 |
2.18 |
-8.55 |
0.32 |
0 |
|
|
312706 |
126607523 |
1 |
ON6C25H34 |
AB6C25D34 |
16.08 |
3.58 |
-8.11 |
0.29 |
0 |
|
|
312707 |
126607533 |
1 |
N5O7C26H35 |
A5B7C26D35 |
-173.81 |
2.84 |
-9.39 |
-0.9 |
0 |
|
|
312708 |
126607544 |
1 |
FSN8C30H31 |
ABC8D30E31 |
139.16 |
3.25 |
-8.52 |
-1.08 |
0 |
|
|
312709 |
126607545 |
1 |
FON6C30H35 |
ABC6D30E35 |
13.65 |
5.17 |
-8.63 |
-0.88 |
0 |
|
|
312710 |
126607546 |
1 |
FN7H26C27 |
AB7C26D27 |
146.0 |
3.49 |
-8.45 |
-0.6 |
0 |