List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
403263 |
135059443 |
1 |
BrClN2O4H10C13 |
ABC2D4E10F13 |
-11.25 |
3.93 |
-9.73 |
-1.68 |
0 |
|
|
403264 |
135059445 |
1 |
ClIO6C34H46 |
ABC6D34E46 |
-302.39 |
4.83 |
-9.75 |
-1.2 |
0 |
|
|
403265 |
135059448 |
1 |
BrO3N4H17C21 |
AB3C4D17E21 |
70.14 |
9.2 |
-8.89 |
-1.4 |
0 |
|
|
403266 |
135059450 |
1 |
OH10C14 |
AB10C14 |
46.28 |
2.44 |
-8.88 |
-0.8 |
0 |
|
|
403267 |
135059453 |
1 |
NO5C13H19 |
AB5C13D19 |
-211.79 |
2.75 |
-8.75 |
-0.62 |
-2 |
|
|
403268 |
135059455 |
1 |
NPO9C14H18 |
ABC9D14E18 |
-407.76 |
2.28 |
-9.59 |
-0.65 |
0 |
|
|
403269 |
135059458 |
1 |
NO3C12H23 |
AB3C12D23 |
-179.79 |
1.87 |
-10.0 |
0.67 |
-1 |
|
|
403270 |
135059461 |
1 |
N2O17C25H33 |
A2B17C25D33 |
-618.87 |
8.85 |
0.0 |
0.0 |
-1 |
|
|
403271 |
135059463 |
1 |
N2O18C26H35 |
A2B18C26D35 |
-688.56 |
9.65 |
0.0 |
0.0 |
0 |
|
|
403272 |
135059476 |
1 |
OSiC19H24 |
ABC19D24 |
-56.89 |
1.54 |
-9.22 |
0.09 |
0 |
|
|
403273 |
135059485 |
1 |
NSiO3C28H31 |
ABC3D28E31 |
-87.65 |
1.94 |
-9.07 |
-0.14 |
0 |
|
|
403274 |
135059487 |
1 |
OSiC26H32 |
ABC26D32 |
-10.3 |
0.92 |
-8.75 |
-0.17 |
0 |
|
|
403275 |
135059491 |
1 |
N2O3S3H6C15F18 |
A2B3C3D6E15F18 |
-1007.61 |
7.39 |
-9.69 |
-1.62 |
0 |
|
|
403276 |
135059500 |
1 |
O2H16C17 |
A2B16C17 |
-26.33 |
1.93 |
-8.36 |
-0.45 |
0 |
|
|
403277 |
135059510 |
1 |
SO7H10C12 |
AB7C10D12 |
-224.48 |
4.88 |
-9.28 |
-1.13 |
0 |
|
|
403278 |
135059512 |
1 |
O2C11H12 |
A2B11C12 |
-45.06 |
3.71 |
-10.12 |
-0.76 |
0 |
|
|
403279 |
135059540 |
1 |
NO5C16H17 |
AB5C16D17 |
-148.01 |
1.65 |
-9.04 |
-1.25 |
0 |
|
|
403280 |
135059541 |
1 |
SO3H12C15 |
AB3C12D15 |
-48.29 |
7.38 |
-8.67 |
-1.09 |
0 |
|
|
403281 |
135059542 |
1 |
OH12C14 |
AB12C14 |
0.8 |
0.97 |
-8.5 |
-0.39 |
0 |
|
|
403282 |
135059543 |
1 |
SO3C16H16 |
AB3C16D16 |
-91.88 |
6.09 |
-9.14 |
-1.0 |
0 |
|
|
403283 |
135059544 |
1 |
SO5H12C14 |
AB5C12D14 |
-153.59 |
6.19 |
-9.04 |
-0.81 |
0 |
|
|
403284 |
135059545 |
1 |
SO3H12C14 |
AB3C12D14 |
-85.54 |
6.58 |
-9.2 |
-0.95 |
0 |
|
|
403285 |
135059557 |
1 |
BrON4H23C25 |
ABC4D23E25 |
93.15 |
7.11 |
-8.88 |
-0.63 |
0 |
|
|
403286 |
135059558 |
1 |
BrO2H27C29 |
AB2C27D29 |
-3.92 |
1.07 |
-8.83 |
-0.47 |
0 |
|
|
403287 |
135059562 |
2 |
NH8C9 |
AB8C9 |
94.48 |
4.5 |
-8.89 |
-0.41 |
0 |
|
|
403288 |
135059583 |
1 |
O5C14H16 |
A5B14C16 |
-201.55 |
5.11 |
-9.34 |
-1.04 |
0 |
|
|
403289 |
135059584 |
1 |
BrNO3C14H16 |
ABC3D14E16 |
-80.57 |
1.95 |
-9.83 |
-1.28 |
0 |
|
|
403290 |
135059585 |
1 |
N2O5C14H16 |
A2B5C14D16 |
-87.07 |
5.35 |
-10.63 |
-1.76 |
0 |
|
|
403291 |
135059586 |
2 |
OC11H11 |
AB11C11 |
-38.54 |
2.24 |
-8.81 |
-0.71 |
0 |
|
|
403292 |
135059589 |
1 |
O3C16H20 |
A3B16C20 |
-123.25 |
1.92 |
-8.86 |
0.04 |
0 |
|
|
403293 |
135059591 |
1 |
BBrNO3C14H19 |
ABCD3E14F19 |
-209.86 |
3.92 |
-9.16 |
-0.46 |
-1 |
|
|
403294 |
135059592 |
1 |
BBrNO3C14H18 |
ABCD3E14F18 |
-172.51 |
0.82 |
0.0 |
0.0 |
0 |
|
|
403295 |
135059597 |
1 |
N2O4H24C25 |
A2B4C24D25 |
-86.42 |
1.74 |
-8.14 |
-1.43 |
0 |
|
|
403296 |
135059598 |
1 |
SiN3O6C23H31 |
AB3C6D23E31 |
-193.43 |
7.41 |
-9.02 |
-1.31 |
0 |
|
|
403297 |
135059603 |
1 |
NOH23C25 |
ABC23D25 |
33.7 |
2.96 |
-8.39 |
-0.26 |
0 |
|
|
403298 |
135059604 |
1 |
BrNCl2H8C15 |
ABC2D8E15 |
61.55 |
2.67 |
-9.41 |
-1.3 |
0 |
|
|
403299 |
135059614 |
1 |
BrO2F3N6H20C23 |
AB2C3D6E20F23 |
-85.4 |
2.56 |
-9.41 |
-1.86 |
0 |
|
|
403300 |
135059615 |
1 |
F3O3N7H20C24 |
A3B3C7D20E24 |
-58.74 |
4.7 |
-9.32 |
-1.71 |
0 |
|
|
403301 |
135059616 |
1 |
NPO5C10H20 |
ABC5D10E20 |
-255.54 |
3.5 |
-10.07 |
0.26 |
0 |
|
|
403302 |
135059617 |
1 |
ISC10H11 |
ABC10D11 |
21.3 |
2.12 |
-8.46 |
-0.97 |
0 |
|
|
403303 |
135059619 |
1 |
ISN2O2H15C17 |
ABC2D2E15F17 |
3.72 |
4.9 |
-9.02 |
-1.15 |
0 |
|
|
403304 |
135059621 |
1 |
BrOSN3H14C16 |
ABCD3E14F16 |
71.72 |
8.53 |
-9.22 |
-0.83 |
0 |
|
|
403305 |
135059625 |
1 |
O7H24C28 |
A7B24C28 |
-202.46 |
1.99 |
-8.84 |
-0.44 |
0 |
|
|
403306 |
135059658 |
1 |
NO6H21C23 |
AB6C21D23 |
-87.21 |
8.24 |
-9.14 |
-1.33 |
0 |
|
|
403307 |
135059660 |
2 |
FOC7H8 |
ABC7D8 |
-159.49 |
2.38 |
-9.63 |
-0.55 |
0 |
|
|
403308 |
135059666 |
1 |
NPSC13H20 |
ABCD13E20 |
-41.5 |
6.09 |
-8.63 |
-0.27 |
0 |
|
|
403309 |
135059668 |
1 |
OPC12H21 |
ABC12D21 |
-96.35 |
4.85 |
-9.33 |
0.9 |
0 |
|
|
403310 |
135059674 |
1 |
OPS3C26H27 |
ABC3D26E27 |
-6.38 |
5.98 |
-8.65 |
-0.8 |
0 |
|
|
403311 |
135059692 |
1 |
Si2O7C28H46 |
A2B7C28D46 |
-496.24 |
1.9 |
-8.26 |
0.0 |
0 |
|
|
403312 |
135059693 |
1 |
NO2C24H33 |
AB2C24D33 |
-85.49 |
1.45 |
-9.26 |
-0.24 |
0 |
|
|
403313 |
135059698 |
1 |
ClSO3H7C12 |
ABC3D7E12 |
-74.16 |
5.03 |
-9.31 |
-1.42 |
0 |
|
|
403314 |
135059706 |
1 |
NOC13H17 |
ABC13D17 |
-29.84 |
3.25 |
-8.43 |
0.14 |
0 |
|
|
403315 |
135059707 |
2 |
NOH14C17 |
ABC14D17 |
55.22 |
3.21 |
-7.88 |
-0.53 |
0 |
|
|
403316 |
135059710 |
1 |
BrS2N3O6C21H26 |
AB2C3D6E21F26 |
-145.09 |
7.18 |
-9.4 |
-1.82 |
0 |
|
|
403317 |
135059711 |
1 |
BrSO3N4C17H19 |
ABC3D4E17F19 |
-18.0 |
6.24 |
-9.61 |
-0.94 |
0 |
|
|
403318 |
135059712 |
1 |
N2H10C13 |
A2B10C13 |
80.24 |
4.76 |
-9.24 |
-1.09 |
0 |
|
|
403319 |
135059713 |
1 |
SeN2C8H17 |
AB2C8D17 |
21.94 |
3.6 |
0.0 |
0.0 |
0 |
|
|
403320 |
135059721 |
1 |
NO3C16H19 |
AB3C16D19 |
-70.54 |
4.66 |
-9.11 |
-0.66 |
0 |
|
|
403321 |
135059733 |
1 |
N2O2H16C17 |
A2B2C16D17 |
-17.06 |
3.82 |
-8.63 |
-0.97 |
0 |
|
|
403322 |
135059736 |
1 |
ClSN2O2H13C18 |
ABC2D2E13F18 |
-1.91 |
9.23 |
-8.84 |
-0.96 |
0 |
|
|
403323 |
135059739 |
2 |
N2O3H12C14 |
A2B3C12D14 |
-36.85 |
6.87 |
-7.92 |
-2.39 |
0 |
|
|
403324 |
135059740 |
1 |
N2H18C21 |
A2B18C21 |
103.49 |
3.11 |
-8.26 |
-0.49 |
0 |
|
|
403325 |
135059741 |
1 |
BN3O5H16C17 |
AB3C5D16E17 |
-200.58 |
7.13 |
-8.06 |
-0.79 |
0 |
|
|
403326 |
135059743 |
1 |
SN3O5H29C30 |
AB3C5D29E30 |
-116.52 |
6.11 |
-8.6 |
-0.89 |
0 |
|
|
403327 |
135059750 |
1 |
N2O2H16C19 |
A2B2C16D19 |
-2.29 |
1.21 |
-8.53 |
-0.47 |
0 |
|
|
403328 |
135059757 |
1 |
ICl2N2O4H23C29 |
AB2C2D4E23F29 |
-65.95 |
1.6 |
-8.47 |
-1.11 |
0 |
|
|
403329 |
135059760 |
1 |
ClIN2O2F3C29H29 |
ABC2D2E3F29G29 |
-197.85 |
5.67 |
-9.31 |
-1.3 |
0 |
|
|
403330 |
135059761 |
1 |
ClN2O3H15C19 |
AB2C3D15E19 |
30.54 |
3.66 |
-9.64 |
-1.74 |
0 |
|
|
403331 |
135059767 |
1 |
SO2N3H29C33 |
AB2C3D29E33 |
72.84 |
10.46 |
-8.46 |
-1.08 |
0 |
|
|
403332 |
135059768 |
1 |
NSO2C16H17 |
ABC2D16E17 |
-53.36 |
4.06 |
-8.82 |
-0.56 |
1 |
|
|
403333 |
135059774 |
1 |
NOS2C13H16 |
ABC2D13E16 |
5.68 |
5.44 |
0.0 |
0.0 |
0 |
|
|
403334 |
135059775 |
1 |
NiC6H8 |
AB6C8 |
75.97 |
0.51 |
-7.34 |
0.78 |
0 |
|
|
403335 |
135059776 |
2 |
O2C4H9 |
A2B4C9 |
-201.35 |
2.01 |
-10.15 |
1.86 |
0 |
|
|
403336 |
135059779 |
1 |
BC14H23 |
AB14C23 |
-31.38 |
1.54 |
-9.06 |
0.89 |
0 |
|
|
403337 |
135059781 |
1 |
OC15H28 |
AB15C28 |
-74.81 |
2.66 |
-8.9 |
0.55 |
0 |