List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
54355 |
17103025 |
1 |
SN3O3C27H27 |
AB3C3D27E27 |
-37.03 |
5.44 |
-8.81 |
-0.95 |
0 |
|
|
54356 |
17111974 |
1 |
ClN2O4C25H33 |
AB2C4D25E33 |
-143.56 |
4.51 |
-8.25 |
-0.38 |
0 |
|
|
54357 |
17112212 |
1 |
ClSN3O3H24C26 |
ABC3D3E24F26 |
-37.91 |
3.44 |
-8.77 |
-1.25 |
0 |
|
|
54358 |
17112486 |
1 |
NO4C29H29 |
AB4C29D29 |
-77.28 |
7.66 |
-8.72 |
-0.96 |
0 |
|
|
54359 |
17114209 |
1 |
BrSN3O5H16C20 |
ABC3D5E16F20 |
-38.92 |
6.4 |
-8.83 |
-1.58 |
0 |
|
|
54360 |
17114859 |
1 |
BrSO3N4H19C23 |
ABC3D4E19F23 |
1.85 |
8.04 |
-8.87 |
-1.35 |
0 |
|
|
54361 |
17118784 |
1 |
SO3N4C25H26 |
AB3C4D25E26 |
-66.1 |
2.91 |
-8.8 |
-0.73 |
0 |
|
|
54362 |
17122068 |
1 |
SO2N3H9C13 |
AB2C3D9E13 |
5.32 |
5.61 |
-9.45 |
-1.38 |
0 |
|
|
54363 |
17132714 |
1 |
ClFSN5C20H27 |
ABCD5E20F27 |
-2.1 |
7.67 |
-8.5 |
-1.27 |
0 |
|
|
54364 |
17132880 |
1 |
OS2N4C19H20 |
AB2C4D19E20 |
76.85 |
5.4 |
-8.04 |
-0.82 |
0 |
|
|
54365 |
17136991 |
1 |
ClFSO2N4H16C18 |
ABCD2E4F16G18 |
-33.97 |
4.17 |
-9.08 |
-0.88 |
0 |
|
|
54366 |
17136998 |
1 |
BrO2S2N4H23C25 |
AB2C2D4E23F25 |
44.3 |
5.91 |
-9.04 |
-1.1 |
0 |
|
|
54367 |
17137002 |
1 |
ClO2S3N6H19C21 |
AB2C3D6E19F21 |
76.29 |
8.26 |
-9.0 |
-1.42 |
0 |
|
|
54368 |
17137005 |
1 |
SO4N5H17C18 |
AB4C5D17E18 |
16.13 |
8.81 |
-9.46 |
-1.39 |
0 |
|
|
54369 |
17137031 |
1 |
SN4O4C20H22 |
AB4C4D20E22 |
-52.97 |
3.12 |
-8.45 |
-0.73 |
0 |
|
|
54370 |
17137043 |
1 |
SN3O3C13H15 |
AB3C3D13E15 |
-49.67 |
2.52 |
-8.98 |
-0.68 |
0 |
|
|
54371 |
17137077 |
1 |
SO2N5C20H23 |
AB2C5D20E23 |
18.85 |
2.96 |
-8.04 |
-0.7 |
0 |
|
|
54372 |
17137086 |
1 |
SO2N5H17C19 |
AB2C5D17E19 |
47.43 |
6.26 |
-9.21 |
-0.95 |
0 |
|
|
54373 |
17137087 |
1 |
BrO2S2N5H16C19 |
AB2C2D5E16F19 |
55.18 |
6.84 |
-9.34 |
-1.15 |
0 |
|
|
54374 |
17137090 |
1 |
SO3N7C18H19 |
AB3C7D18E19 |
-6.08 |
4.88 |
-9.19 |
-1.08 |
0 |
|
|
54375 |
17137096 |
1 |
ClSO3N4C19H19 |
ABC3D4E19F19 |
-32.59 |
5.83 |
-8.58 |
-0.9 |
0 |
|
|
54376 |
17137105 |
1 |
SO2N4C20H22 |
AB2C4D20E22 |
7.84 |
8.43 |
-8.74 |
-0.72 |
0 |
|
|
54377 |
17137106 |
1 |
SO2N4C20H22 |
AB2C4D20E22 |
8.97 |
7.73 |
-8.79 |
-0.58 |
0 |
|
|
54378 |
17137107 |
1 |
ClSO2N4C19H19 |
ABC2D4E19F19 |
5.33 |
5.1 |
-9.06 |
-0.76 |
0 |
|
|
54379 |
17137117 |
1 |
SO3N4C21H24 |
AB3C4D21E24 |
-34.1 |
3.19 |
-8.49 |
-0.8 |
0 |
|
|
54380 |
17137122 |
1 |
SCl2O2N4H18C19 |
AB2C2D4E18F19 |
-7.41 |
7.76 |
-8.79 |
-0.89 |
0 |
|
|
54381 |
17137123 |
1 |
SO2N4C21H24 |
AB2C4D21E24 |
-2.64 |
6.57 |
-8.55 |
-0.69 |
0 |
|
|
54382 |
17137128 |
1 |
SO2N5C18H19 |
AB2C5D18E19 |
26.01 |
3.97 |
-8.79 |
-0.49 |
0 |
|
|
54383 |
17137132 |
1 |
SO2N4H24C25 |
AB2C4D24E25 |
40.84 |
3.86 |
-9.06 |
-0.74 |
0 |
|
|
54384 |
17137143 |
1 |
BrOSN4H17C18 |
ABCD4E17F18 |
53.48 |
5.17 |
-9.05 |
-0.76 |
0 |
|
|
54385 |
17137150 |
1 |
OSCl2N4H16C18 |
ABC2D4E16F18 |
31.27 |
3.3 |
-9.17 |
-0.82 |
0 |
|
|
54386 |
17137154 |
1 |
IOSN4H17C18 |
ABCD4E17F18 |
66.99 |
7.42 |
-8.91 |
-0.84 |
0 |
|
|
54387 |
17137156 |
1 |
OSN4C12H14 |
ABC4D12E14 |
21.06 |
3.4 |
-9.15 |
-0.74 |
0 |
|
|
54388 |
17137157 |
1 |
OSN4C16H22 |
ABC4D16E22 |
10.27 |
1.65 |
-8.56 |
-0.44 |
0 |
|
|
54389 |
17137175 |
1 |
OSN3C18H19 |
ABC3D18E19 |
49.59 |
5.55 |
-8.62 |
-0.47 |
0 |
|
|
54390 |
17137185 |
1 |
SO3N4C21H24 |
AB3C4D21E24 |
-26.0 |
9.83 |
-8.61 |
-0.66 |
0 |
|
|
54391 |
17137189 |
1 |
SO2N4C20H22 |
AB2C4D20E22 |
7.59 |
5.08 |
-8.73 |
-0.7 |
0 |
|
|
54392 |
17137226 |
1 |
OSF2N4H16C18 |
ABC2D4E16F18 |
-43.02 |
6.53 |
-9.09 |
-0.84 |
0 |
|
|
54393 |
17137234 |
1 |
ClOS3N6H19C21 |
ABC3D6E19F21 |
108.67 |
2.08 |
-8.92 |
-1.16 |
0 |
|
|
54394 |
17137236 |
1 |
SO3N5H17C18 |
AB3C5D17E18 |
45.36 |
10.67 |
-9.38 |
-1.36 |
0 |
|
|
54395 |
17137248 |
1 |
SN3C20H23 |
AB3C20D23 |
64.69 |
6.92 |
-8.67 |
-0.72 |
0 |
|
|
54396 |
17137255 |
1 |
SO3N4C22H26 |
AB3C4D22E26 |
-36.73 |
6.76 |
-8.2 |
-0.74 |
0 |
|
|
54397 |
17137279 |
1 |
SN3C12H15 |
AB3C12D15 |
60.03 |
5.03 |
-8.63 |
-0.51 |
0 |
|
|
54398 |
17137287 |
1 |
OS2N4C21H24 |
AB2C4D21E24 |
36.82 |
4.36 |
-8.85 |
-0.63 |
0 |
|
|
54399 |
17138135 |
1 |
NO3C23H31 |
AB3C23D31 |
-119.12 |
4.54 |
-8.62 |
-0.29 |
0 |
|
|
54400 |
17141557 |
1 |
S2N3O3C19H23 |
A2B3C3D19E23 |
-105.72 |
4.58 |
-8.25 |
-1.01 |
0 |
|
|
54401 |
17141561 |
1 |
S2N3O4C22H29 |
A2B3C4D22E29 |
-143.39 |
10.97 |
-8.98 |
-1.19 |
0 |
|
|
54402 |
17141563 |
1 |
S2N3O4C20H25 |
A2B3C4D20E25 |
-120.46 |
11.81 |
-9.0 |
-1.18 |
0 |
|
|
54403 |
17141594 |
1 |
SN3O3C23H27 |
AB3C3D23E27 |
-86.56 |
4.82 |
-8.66 |
-0.79 |
0 |
|
|
54404 |
17141599 |
1 |
S2N3O4C26H29 |
A2B3C4D26E29 |
-108.82 |
11.82 |
-9.05 |
-1.23 |
0 |
|
|
54405 |
17144991 |
1 |
SN2O5C28H38 |
AB2C5D28E38 |
-205.79 |
3.6 |
-9.05 |
-0.42 |
0 |
|
|
54406 |
17150550 |
2 |
NO2C12H16 |
AB2C12D16 |
-158.41 |
2.32 |
-8.96 |
-0.35 |
0 |
|
|
54407 |
17150794 |
2 |
ClNO2C12H15 |
ABC2D12E15 |
-151.1 |
3.56 |
-8.93 |
-0.53 |
0 |
|
|
54408 |
17153668 |
1 |
SN4O6C27H34 |
AB4C6D27E34 |
-224.48 |
10.69 |
-9.47 |
-1.07 |
0 |
|
|
54409 |
17153674 |
1 |
SO4N5C22H29 |
AB4C5D22E29 |
-113.32 |
9.18 |
-9.61 |
-1.06 |
0 |
|
|
54410 |
17153678 |
2 |
N2O2C13H16 |
A2B2C13D16 |
-159.13 |
4.05 |
-8.92 |
-0.72 |
0 |
|
|
54411 |
17153707 |
1 |
N3O3C25H31 |
A3B3C25D31 |
-111.71 |
2.93 |
-8.74 |
-0.54 |
0 |
|
|
54412 |
17153743 |
1 |
FN3O3H20C24 |
AB3C3D20E24 |
-98.4 |
4.58 |
-9.0 |
-0.81 |
0 |
|
|
54413 |
17154071 |
1 |
ISN2O3C16H17 |
ABC2D3E16F17 |
-75.0 |
10.55 |
-8.64 |
-0.89 |
0 |
|
|
54414 |
17154095 |
1 |
SN2O5C18H22 |
AB2C5D18E22 |
-163.97 |
7.83 |
-8.54 |
-0.52 |
0 |
|
|
54415 |
17154167 |
1 |
S2N3O5C20H25 |
A2B3C5D20E25 |
-165.14 |
6.45 |
-9.41 |
-0.74 |
0 |
|
|
54416 |
17154637 |
1 |
N3O3C25H25 |
A3B3C25D25 |
-72.13 |
2.62 |
-9.12 |
-0.41 |
0 |
|
|
54417 |
17154638 |
1 |
N3O4C22H25 |
A3B4C22D25 |
-139.72 |
6.63 |
-9.11 |
-0.62 |
0 |
|
|
54418 |
17154667 |
2 |
NO2C8H8 |
AB2C8D8 |
-51.88 |
6.02 |
-8.99 |
-1.83 |
0 |
|
|
54419 |
17155250 |
1 |
BrFNO3C18H21 |
ABCD3E18F21 |
-123.51 |
1.86 |
-9.1 |
-0.4 |
0 |
|
|
54421 |
17385821 |
1 |
ClN3O6H14C16 |
AB3C6D14E16 |
-94.15 |
6.73 |
-8.89 |
-2.02 |
0 |
|
|
54422 |
17388035 |
1 |
FOSN3C19H24 |
ABCD3E19F24 |
-68.82 |
3.68 |
-8.89 |
-0.9 |
0 |
|
|
54423 |
17388640 |
2 |
Na2C3S3H5O6 |
A2B3C3D5E6 |
-671.3 |
22.5 |
-9.22 |
-1.27 |
0 |
|
|
54424 |
17388642 |
1 |
Cl2N4H10C15 |
A2B4C10D15 |
134.53 |
2.02 |
-8.64 |
-1.95 |
0 |
|
|
54425 |
17388655 |
1 |
Br3N3C14H20 |
A3B3C14D20 |
54.65 |
18.13 |
-8.03 |
-2.43 |
0 |
|
|
54427 |
17388663 |
1 |
O5C25H36 |
A5B25C36 |
-216.47 |
1.87 |
-9.36 |
0.14 |
0 |
|
|
54428 |
17388664 |
1 |
O4C23H32 |
A4B23C32 |
-172.62 |
2.48 |
-9.43 |
0.25 |
0 |
|
|
54429 |
17388665 |
1 |
NCl2C15H19 |
AB2C15D19 |
15.79 |
11.55 |
-8.4 |
-1.04 |
0 |
|
|
54430 |
17388666 |
1 |
BrNC18H22 |
ABC18D22 |
79.68 |
11.92 |
-8.02 |
-0.96 |
0 |
|
|
54431 |
17388667 |
2 |
BrNC15H18 |
ABC15D18 |
71.51 |
0.57 |
-8.07 |
-1.12 |
0 |