List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
123362 |
50844150 |
1 |
SN2O4C13H16 |
AB2C4D13E16 |
-80.41 |
8.22 |
-10.14 |
-0.56 |
0 |
|
|
123363 |
50844151 |
1 |
N2O5C24H24 |
A2B5C24D24 |
-142.94 |
6.96 |
-8.99 |
-1.09 |
0 |
|
|
123364 |
50844152 |
1 |
N2O3H22C23 |
A2B3C22D23 |
-70.46 |
5.77 |
-9.25 |
-1.2 |
0 |
|
|
123365 |
50844153 |
1 |
ON2C18H22 |
AB2C18D22 |
-13.38 |
2.72 |
-8.29 |
0.06 |
0 |
|
|
123366 |
50844154 |
1 |
ON3H19C21 |
AB3C19D21 |
46.43 |
6.75 |
-8.47 |
-0.92 |
0 |
|
|
123367 |
50844155 |
1 |
SO2N4C21H28 |
AB2C4D21E28 |
-19.87 |
3.92 |
-8.26 |
-0.73 |
0 |
|
|
123368 |
50844156 |
1 |
ClOSN3C17H20 |
ABCD3E17F20 |
4.32 |
3.73 |
-8.68 |
-0.66 |
0 |
|
|
123369 |
50844225 |
1 |
FO2N3H20C22 |
AB2C3D20E22 |
-66.95 |
8.9 |
-8.76 |
-0.86 |
0 |
|
|
123370 |
50844259 |
1 |
SO2N5C23H23 |
AB2C5D23E23 |
42.31 |
7.24 |
-9.21 |
-1.4 |
0 |
|
|
123371 |
50844311 |
1 |
FSN2O3H15C17 |
ABC2D3E15F17 |
-60.67 |
6.78 |
-10.12 |
-0.64 |
0 |
|
|
123372 |
50844312 |
1 |
SN2O4H12C14 |
AB2C4D12E14 |
-37.91 |
7.4 |
-10.05 |
-0.97 |
0 |
|
|
123373 |
50844384 |
1 |
SO2N4C18H20 |
AB2C4D18E20 |
-22.68 |
2.77 |
-8.83 |
-1.2 |
0 |
|
|
123374 |
50844385 |
1 |
SO2N4C20H24 |
AB2C4D20E24 |
-43.24 |
2.67 |
-8.65 |
-1.16 |
0 |
|
|
123375 |
50844639 |
1 |
FSO2N4C21H23 |
ABC2D4E21F23 |
-78.8 |
3.69 |
-8.69 |
-1.04 |
0 |
|
|
123376 |
50844672 |
1 |
SO2N6C21H26 |
AB2C6D21E26 |
-5.57 |
2.76 |
-8.52 |
-1.04 |
0 |
|
|
123377 |
50844673 |
1 |
SO2N4C21H24 |
AB2C4D21E24 |
-36.82 |
2.51 |
-8.75 |
-1.08 |
0 |
|
|
123378 |
50844674 |
1 |
SO2N4C21H24 |
AB2C4D21E24 |
-37.33 |
4.21 |
-8.6 |
-0.96 |
0 |
|
|
123379 |
50844710 |
1 |
FSO2N5H20C21 |
ABC2D5E20F21 |
-38.54 |
6.94 |
-8.83 |
-1.18 |
0 |
|
|
123380 |
50844833 |
1 |
SO2N7C17H17 |
AB2C7D17E17 |
38.58 |
9.41 |
-8.68 |
-1.51 |
0 |
|
|
123381 |
50844921 |
1 |
S2O3N5C23H35 |
A2B3C5D23E35 |
-99.27 |
10.32 |
-8.45 |
-1.08 |
0 |
|
|
123382 |
50845058 |
1 |
ClFS2O3N4C21H22 |
ABC2D3E4F21G22 |
-111.45 |
12.09 |
-8.67 |
-1.15 |
0 |
|
|
123383 |
50845382 |
1 |
SO2N3C20H21 |
AB2C3D20E21 |
-17.76 |
6.52 |
-8.16 |
-0.92 |
0 |
|
|
123384 |
50845389 |
1 |
O2N4C27H32 |
A2B4C27D32 |
-30.82 |
6.29 |
-8.94 |
-0.04 |
0 |
|
|
123385 |
50845418 |
1 |
ClON3C19H28 |
ABC3D19E28 |
-55.18 |
6.85 |
-8.81 |
-0.03 |
0 |
|
|
123386 |
50845447 |
1 |
SN3O3C21H21 |
AB3C3D21E21 |
-51.61 |
4.23 |
-8.21 |
-0.92 |
0 |
|
|
123387 |
50845451 |
1 |
F2O2N5H17C22 |
A2B2C5D17E22 |
-30.77 |
1.17 |
-8.7 |
-1.25 |
0 |
|
|
123388 |
50845505 |
1 |
BrFSO2N3H13C17 |
ABCD2E3F13G17 |
-42.04 |
2.45 |
-9.05 |
-1.16 |
0 |
|
|
123389 |
50845506 |
1 |
SF2O2N3H15C18 |
AB2C2D3E15F18 |
-100.57 |
4.44 |
-8.87 |
-1.13 |
0 |
|
|
123390 |
50845507 |
1 |
SO2N3H19C23 |
AB2C3D19E23 |
26.37 |
6.23 |
-8.46 |
-1.11 |
0 |
|
|
123391 |
50845521 |
1 |
O2F3N4C26H27 |
A2B3C4D26E27 |
-174.67 |
3.56 |
-8.91 |
-0.73 |
0 |
|
|
123392 |
50845522 |
1 |
O2F3N4C26H27 |
A2B3C4D26E27 |
-177.45 |
7.67 |
-8.75 |
-0.72 |
0 |
|
|
123393 |
50845524 |
1 |
SO2N5C25H35 |
AB2C5D25E35 |
-61.54 |
6.76 |
-8.74 |
-0.66 |
0 |
|
|
123394 |
50845525 |
1 |
SO2N5C23H31 |
AB2C5D23E31 |
-66.09 |
9.11 |
-8.26 |
-0.5 |
0 |
|
|
123395 |
50845674 |
1 |
ClNSO2F3H13C18 |
ABCD2E3F13G18 |
-188.13 |
4.34 |
-8.78 |
-1.32 |
0 |
|
|
123396 |
50845675 |
1 |
O4N5C22H33 |
A4B5C22D33 |
-175.01 |
3.29 |
-8.08 |
0.2 |
0 |
|
|
123397 |
50845676 |
1 |
O4N5C20H31 |
A4B5C20D31 |
-173.42 |
8.91 |
-8.13 |
0.24 |
0 |
|
|
123398 |
50845677 |
1 |
O3N5C25H31 |
A3B5C25D31 |
-89.07 |
7.9 |
-8.34 |
-0.21 |
0 |
|
|
123399 |
50845712 |
1 |
O3N5C24H31 |
A3B5C24D31 |
-115.93 |
6.61 |
-8.32 |
-0.09 |
0 |
|
|
123400 |
50845731 |
1 |
ClNSO4H18C19 |
ABCD4E18F19 |
-109.2 |
4.09 |
-8.7 |
-1.3 |
0 |
|
|
123401 |
50845736 |
1 |
O3N5C22H27 |
A3B5C22D27 |
-96.64 |
10.91 |
-8.58 |
-0.28 |
0 |
|
|
123402 |
50845776 |
1 |
O3N5C24H31 |
A3B5C24D31 |
-105.39 |
5.55 |
-8.74 |
-0.18 |
0 |
|
|
123403 |
50845777 |
1 |
SN3O3C22H29 |
AB3C3D22E29 |
-92.0 |
6.33 |
-8.86 |
-0.72 |
0 |
|
|
123404 |
50845861 |
1 |
ClNSO2F3H13C18 |
ABCD2E3F13G18 |
-188.1 |
4.49 |
-8.71 |
-1.33 |
0 |
|
|
123405 |
50845902 |
1 |
O3N5C23H35 |
A3B5C23D35 |
-146.37 |
7.51 |
-8.12 |
0.25 |
0 |
|
|
123406 |
50846010 |
1 |
O2N5C25H35 |
A2B5C25D35 |
-49.25 |
5.36 |
-8.45 |
-0.55 |
0 |
|
|
123407 |
50846020 |
1 |
ClNSF2O2H10C16 |
ABCD2E2F10G16 |
-112.43 |
5.95 |
-8.85 |
-1.44 |
0 |
|
|
123408 |
50846024 |
1 |
ClNSO2H14C17 |
ABCD2E14F17 |
-25.07 |
4.44 |
-8.69 |
-1.23 |
0 |
|
|
123409 |
50846087 |
1 |
ClNSO4C20H20 |
ABCD4E20F20 |
-108.53 |
4.36 |
-8.31 |
-1.2 |
0 |
|
|
123410 |
50846105 |
1 |
N3O3C19H31 |
A3B3C19D31 |
-153.4 |
6.17 |
-8.41 |
0.93 |
0 |
|
|
123411 |
50846106 |
1 |
ClON5C22H28 |
ABC5D22E28 |
10.37 |
6.08 |
-8.19 |
-0.56 |
0 |
|
|
123412 |
50846107 |
1 |
ON5C24H33 |
AB5C24D33 |
-1.17 |
5.34 |
-8.36 |
-0.28 |
0 |
|
|
123413 |
50846336 |
1 |
N3O3C26H29 |
A3B3C26D29 |
-81.1 |
7.67 |
-9.07 |
-1.26 |
0 |
|
|
123414 |
50846400 |
1 |
O2N4H22C23 |
A2B4C22D23 |
5.92 |
6.47 |
-9.13 |
-1.01 |
0 |
|
|
123415 |
50846438 |
1 |
N2O3C26H32 |
A2B3C26D32 |
-107.17 |
5.05 |
-9.08 |
-0.14 |
0 |
|
|
123416 |
50846459 |
1 |
N3O3C27H35 |
A3B3C27D35 |
-95.31 |
6.27 |
-8.51 |
-0.15 |
0 |
|
|
123417 |
50846545 |
1 |
N2O3C24H28 |
A2B3C24D28 |
-96.69 |
3.22 |
-9.01 |
0.02 |
0 |
|
|
123418 |
50846563 |
1 |
ClON5C17H18 |
ABC5D17E18 |
23.06 |
8.79 |
-8.93 |
-0.85 |
0 |
|
|
123419 |
50846564 |
1 |
N3O3C22H23 |
A3B3C22D23 |
-34.94 |
6.21 |
-9.18 |
-0.94 |
0 |
|
|
123420 |
50846652 |
1 |
ClN2O3C24H27 |
AB2C3D24E27 |
-97.04 |
3.13 |
-9.17 |
-0.71 |
0 |
|
|
123421 |
50846713 |
1 |
ClON3C20H24 |
ABC3D20E24 |
-5.23 |
5.07 |
-8.19 |
-0.61 |
0 |
|
|
123422 |
50846714 |
1 |
N2O4C21H24 |
A2B4C21D24 |
-97.3 |
2.08 |
-9.21 |
-0.38 |
0 |
|
|
123423 |
50846715 |
1 |
N3O3C25H31 |
A3B3C25D31 |
-59.57 |
7.67 |
-8.44 |
-0.58 |
0 |
|
|
123424 |
50846716 |
1 |
F2N2O3C23H24 |
A2B2C3D23E24 |
-159.87 |
7.28 |
-9.12 |
-0.81 |
0 |
|
|
123425 |
50846717 |
1 |
FN2O3C24H27 |
AB2C3D24E27 |
-123.02 |
7.65 |
-9.16 |
-0.31 |
0 |
|
|
123426 |
50846724 |
1 |
ClSF3N4O4H12C15 |
ABC3D4E4F12G15 |
-266.88 |
7.86 |
-9.27 |
-1.66 |
0 |
|
|
123427 |
50846940 |
1 |
N2O3C23H26 |
A2B3C23D26 |
-65.43 |
8.64 |
-9.11 |
-0.33 |
0 |
|
|
123428 |
50846941 |
1 |
ClN2O3C23H25 |
AB2C3D23E25 |
-75.65 |
5.58 |
-9.04 |
-0.53 |
0 |
|
|
123429 |
50847013 |
2 |
SO2N3C9H9 |
AB2C3D9E9 |
-49.48 |
5.69 |
-9.56 |
-1.98 |
0 |
|
|
123430 |
50847191 |
1 |
FON4C22H27 |
ABC4D22E27 |
-58.07 |
5.35 |
-8.49 |
-1.06 |
0 |
|
|
123431 |
50847192 |
1 |
ClO2N3H20C22 |
AB2C3D20E22 |
-15.48 |
1.2 |
-8.83 |
-0.98 |
0 |
|
|
123432 |
50847193 |
1 |
ClON3H18C20 |
ABC3D18E20 |
20.64 |
2.22 |
-8.85 |
-0.42 |
0 |
|
|
123433 |
50847194 |
1 |
BrON3H16C19 |
ABC3D16E19 |
37.83 |
0.65 |
-8.96 |
-0.58 |
0 |
|
|
123434 |
50847195 |
1 |
OF3N3H14C18 |
AB3C3D14E18 |
-113.75 |
6.42 |
-9.59 |
-1.03 |
0 |
|
|
123435 |
50847270 |
1 |
OSF3N4H17C19 |
ABC3D4E17F19 |
-111.45 |
2.48 |
-9.28 |
-1.32 |
0 |
|
|
123436 |
50847361 |
1 |
FOSN4C20H21 |
ABCD4E20F21 |
-20.99 |
2.49 |
-8.93 |
-1.03 |
0 |
|
|
123437 |
50847368 |
1 |
BrOSN4C20H21 |
ABCD4E20F21 |
22.08 |
1.78 |
-8.96 |
-1.08 |
0 |
|
|
123438 |
50847502 |
1 |
OF2N4H20C22 |
AB2C4D20E22 |
-46.81 |
2.45 |
-8.77 |
-0.74 |
0 |
|
|
123439 |
50847503 |
1 |
OF2N4H20C22 |
AB2C4D20E22 |
-47.13 |
3.65 |
-8.8 |
-0.77 |
0 |
|
|
123440 |
50847532 |
1 |
ON4C22H24 |
AB4C22D24 |
35.48 |
3.01 |
-8.85 |
-0.7 |
0 |
|
|
123441 |
50847561 |
1 |
FO2N3C26H32 |
AB2C3D26E32 |
-109.6 |
6.12 |
-8.94 |
-0.09 |
0 |
|
|
123442 |
50847562 |
1 |
O2N3C28H37 |
A2B3C28D37 |
-76.38 |
3.84 |
-8.84 |
0.18 |
0 |
|
|
123443 |
50847563 |
1 |
BrO3N4C20H25 |
AB3C4D20E25 |
-65.51 |
3.7 |
-8.56 |
-1.08 |
0 |
|
|
123444 |
50847616 |
1 |
N2O2C21H24 |
A2B2C21D24 |
-66.23 |
6.72 |
-8.74 |
-0.17 |
0 |
|
|
123445 |
50847686 |
1 |
O2N4C27H34 |
A2B4C27D34 |
-43.68 |
5.63 |
-8.73 |
0.16 |
0 |
|
|
123446 |
50847687 |
1 |
O2N3C25H31 |
A2B3C25D31 |
-62.37 |
3.25 |
-8.9 |
0.11 |
0 |
|
|
123447 |
50847767 |
1 |
ClON5C23H24 |
ABC5D23E24 |
55.52 |
2.17 |
-8.77 |
-0.87 |
0 |
|
|
123448 |
50847768 |
1 |
BrON4H17C18 |
ABC4D17E18 |
45.12 |
4.64 |
-9.19 |
-1.2 |
0 |
|
|
123449 |
50847835 |
1 |
OSN3H15C16 |
ABC3D15E16 |
42.31 |
4.32 |
-8.92 |
-0.67 |
0 |
|
|
123450 |
50848000 |
1 |
N3O4C15H17 |
A3B4C15D17 |
-89.66 |
8.23 |
-9.29 |
-1.06 |
0 |
|
|
123451 |
50848134 |
1 |
O2N3C16H19 |
A2B3C16D19 |
-37.86 |
3.47 |
-9.46 |
-0.98 |
0 |
|
|
123452 |
50848327 |
1 |
ClFSN5O5C17H17 |
ABCD5E5F17G17 |
-198.27 |
3.04 |
-9.23 |
-0.7 |
0 |
|
|
123453 |
50848328 |
1 |
SN5O6C16H19 |
AB5C6D16E19 |
-179.16 |
3.28 |
-9.47 |
-0.65 |
0 |
|
|
123454 |
50848481 |
2 |
ON2C13H15 |
AB2C13D15 |
-27.66 |
4.14 |
-9.0 |
-0.78 |
0 |
|
|
123455 |
50848575 |
1 |
SO2N4C23H26 |
AB2C4D23E26 |
-28.37 |
8.07 |
-8.6 |
-0.74 |
0 |
|
|
123456 |
50848586 |
1 |
SO3N4C22H26 |
AB3C4D22E26 |
-73.38 |
4.67 |
-8.9 |
-1.07 |
0 |
|
|
123457 |
50848642 |
1 |
SO2N5C26H31 |
AB2C5D26E31 |
-24.14 |
4.69 |
-8.9 |
-1.03 |
0 |
|
|
123458 |
50848643 |
1 |
SF2O2N5C24H25 |
AB2C2D5E24F25 |
-102.49 |
4.89 |
-9.01 |
-1.06 |
0 |
|
|
123459 |
50848822 |
1 |
O4N5C26H31 |
A4B5C26D31 |
-88.97 |
5.09 |
-8.26 |
-0.95 |
0 |
|
|
123460 |
50848847 |
1 |
SO3N4C25H28 |
AB3C4D25E28 |
-40.62 |
2.12 |
-8.97 |
-0.89 |
0 |
|
|
123461 |
50848862 |
1 |
SO3N4C21H30 |
AB3C4D21E30 |
-90.45 |
3.42 |
-8.96 |
-0.7 |
0 |