List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
230206 |
87570419 |
1 |
FO3N5C19H20 |
AB3C5D19E20 |
-35.86 |
5.49 |
-9.08 |
-0.99 |
0 |
|
|
230207 |
87570421 |
2 |
SO2C39H58 |
AB2C39D58 |
-167.43 |
3.63 |
-8.12 |
-0.63 |
0 |
|
|
230208 |
87570422 |
1 |
BrO3H15C22 |
AB3C15D22 |
-34.52 |
6.75 |
-9.29 |
-1.08 |
0 |
|
|
230209 |
87570423 |
1 |
FeNO2C3H7 |
ABC2D3E7 |
52.77 |
5.88 |
-5.98 |
1.05 |
0 |
|
|
230211 |
87570425 |
1 |
B2Cl2O5H8C16 |
A2B2C5D8E16 |
-98.87 |
5.3 |
-8.41 |
-1.8 |
0 |
|
|
230212 |
87570427 |
1 |
NO2H19C21 |
AB2C19D21 |
19.05 |
8.02 |
-8.41 |
-0.62 |
0 |
|
|
230213 |
87570428 |
2 |
OC13H24 |
AB13C24 |
-174.25 |
4.9 |
-9.12 |
0.81 |
0 |
|
|
230214 |
87570429 |
2 |
OC13H24 |
AB13C24 |
-165.37 |
4.43 |
-9.56 |
0.81 |
0 |
|
|
230215 |
87570431 |
3 |
OH4C6 |
AB4C6 |
-6.16 |
4.57 |
-9.23 |
-1.02 |
0 |
|
|
230216 |
87570432 |
1 |
N3O4F6H15C21 |
A3B4C6D15E21 |
-417.57 |
0.95 |
-9.36 |
-2.18 |
0 |
|
|
230217 |
87570442 |
1 |
O5N12C43H66 |
A5B12C43D66 |
-69.71 |
9.09 |
-8.3 |
-1.42 |
0 |
|
|
230218 |
87570443 |
1 |
O4F8N9H21C27 |
A4B8C9D21E27 |
-377.58 |
6.68 |
-9.28 |
-1.61 |
0 |
|
|
230219 |
87570445 |
1 |
O3N4H20C23 |
A3B4C20D23 |
-13.39 |
6.7 |
-8.83 |
-1.0 |
0 |
|
|
230220 |
87570447 |
1 |
O5N10C36H52 |
A5B10C36D52 |
-42.65 |
6.78 |
-8.4 |
-2.45 |
0 |
|
|
230221 |
87570452 |
1 |
N2S2F3O6H21C24 |
A2B2C3D6E21F24 |
-295.91 |
13.44 |
-9.64 |
-1.25 |
0 |
|
|
230222 |
87570453 |
1 |
SN4O4C19H20 |
AB4C4D19E20 |
-122.13 |
3.95 |
-9.34 |
-1.06 |
0 |
|
|
230224 |
87570458 |
1 |
ZrO6F8C26H36 |
AB6C8D26E36 |
-549.01 |
4.8 |
-6.76 |
-1.34 |
0 |
|
|
230225 |
87570465 |
1 |
F2S2N3O7H19C25 |
A2B2C3D7E19F25 |
-229.7 |
9.15 |
-9.55 |
-1.41 |
0 |
|
|
230226 |
87570467 |
1 |
NOC15H21 |
ABC15D21 |
-1.9 |
2.51 |
-8.96 |
0.12 |
0 |
|
|
230227 |
87570468 |
1 |
F2S2N3O4C25H25 |
A2B2C3D4E25F25 |
-155.45 |
6.39 |
-8.16 |
-0.98 |
0 |
|
|
230228 |
87570469 |
2 |
O12C35H40 |
A12B35C40 |
-485.22 |
4.27 |
-8.51 |
-0.2 |
0 |
|
|
230229 |
87570470 |
1 |
NO5C21H31 |
AB5C21D31 |
-186.28 |
0.79 |
-9.2 |
0.33 |
0 |
|
|
230230 |
87570472 |
1 |
N2O5C17H24 |
A2B5C17D24 |
-159.7 |
3.46 |
-9.23 |
-0.61 |
0 |
|
|
230232 |
87570481 |
1 |
ON7C25H31 |
AB7C25D31 |
55.88 |
7.71 |
-8.94 |
-0.5 |
0 |
|
|
230233 |
87570482 |
1 |
NO6C21H31 |
AB6C21D31 |
-226.43 |
9.31 |
-8.53 |
-0.12 |
0 |
|
|
230234 |
87570483 |
1 |
PO6C35H71 |
AB6C35D71 |
-461.59 |
3.9 |
-10.1 |
0.66 |
0 |
|
|
230235 |
87570485 |
1 |
SCl2O2N4C25H34 |
AB2C2D4E25F34 |
-65.24 |
4.98 |
-8.74 |
-1.26 |
0 |
|
|
230236 |
87570488 |
1 |
NOCl2C5H13 |
ABC2D5E13 |
-87.59 |
3.51 |
-10.08 |
0.37 |
0 |
|
|
230240 |
87570496 |
1 |
NO7C20H27 |
AB7C20D27 |
-241.43 |
7.81 |
-8.76 |
-0.53 |
0 |
|
|
230241 |
87570505 |
1 |
NO4C23H29 |
AB4C23D29 |
-119.23 |
4.59 |
-8.92 |
0.15 |
0 |
|
|
230242 |
87570507 |
1 |
SN3O4C24H33 |
AB3C4D24E33 |
-75.94 |
2.57 |
-8.5 |
-0.6 |
0 |
|
|
230243 |
87570509 |
1 |
ClFN2O2C21H28 |
ABC2D2E21F28 |
-151.32 |
2.44 |
-9.27 |
-0.33 |
0 |
|
|
230244 |
87570511 |
1 |
NO6C20H25 |
AB6C20D25 |
-160.73 |
3.13 |
-9.64 |
-0.88 |
0 |
|
|
230245 |
87570512 |
4 |
O3C10H12 |
A3B10C12 |
-246.27 |
1.19 |
-8.8 |
-0.24 |
0 |
|
|
230246 |
87570513 |
1 |
SCl2O3N4C24H32 |
AB2C3D4E24F32 |
-94.93 |
1.59 |
-8.63 |
-1.25 |
0 |
|
|
230247 |
87570515 |
1 |
BrO2F3N6C27H30 |
AB2C3D6E27F30 |
-130.95 |
4.07 |
-9.04 |
-1.53 |
0 |
|
|
230248 |
87570517 |
1 |
SCl2O3N4C24H32 |
AB2C3D4E24F32 |
-99.01 |
2.9 |
-8.55 |
-1.25 |
0 |
|
|
230249 |
87570518 |
1 |
S2N3O7C26H27 |
A2B3C7D26E27 |
-176.46 |
10.78 |
-9.07 |
-1.09 |
0 |
|
|
230250 |
87570519 |
1 |
ClS2N3O6C22H26 |
AB2C3D6E22F26 |
-180.13 |
8.13 |
-9.32 |
-1.3 |
0 |
|
|
230251 |
87570521 |
1 |
N2S2O8C9H22 |
A2B2C8D9E22 |
-376.88 |
11.2 |
-10.23 |
-0.97 |
0 |
|
|
230252 |
87570522 |
1 |
N2S2O7C9H20 |
A2B2C7D9E20 |
-319.67 |
6.51 |
-10.1 |
-1.07 |
0 |
|
|
230253 |
87570524 |
1 |
O5H18C21 |
A5B18C21 |
-150.5 |
3.57 |
-9.34 |
-1.16 |
0 |
|
|
230254 |
87570527 |
1 |
NC7O8H9 |
AB7C8D9 |
-337.84 |
3.14 |
-10.67 |
-0.54 |
0 |
|
|
230255 |
87570530 |
1 |
Cl2N2O5H10C18 |
A2B2C5D10E18 |
-119.88 |
6.18 |
-10.12 |
-2.14 |
0 |
|
|
230256 |
87570531 |
1 |
NO5C21H31 |
AB5C21D31 |
-184.98 |
4.19 |
-9.27 |
-0.05 |
0 |
|
|
230257 |
87570533 |
1 |
NS2Cl3F3O10C31H35 |
AB2C3D3E10F31G35 |
-548.68 |
5.77 |
-9.23 |
-1.24 |
0 |
|
|
230258 |
87570534 |
1 |
ClO4N5C21H30 |
AB4C5D21E30 |
-148.94 |
2.86 |
-9.41 |
-0.74 |
0 |
|
|
230259 |
87570535 |
1 |
ClFO3N5C29H39 |
ABC3D5E29F39 |
-168.94 |
6.56 |
-8.82 |
-0.69 |
0 |
|
|
230260 |
87570538 |
1 |
SCl2O3N8C25H36 |
AB2C3D8E25F36 |
-62.83 |
3.51 |
-8.52 |
-1.28 |
0 |
|
|
230261 |
87570539 |
1 |
SN3O3F4H25C28 |
AB3C3D4E25F28 |
-189.59 |
2.1 |
-8.93 |
-1.66 |
0 |