List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
219415 |
85148604 |
1 |
O9C27H34 |
A9B27C34 |
-355.38 |
1.23 |
-8.92 |
-0.49 |
0 |
|
|
219416 |
85148633 |
1 |
BrO2C29H45 |
AB2C29D45 |
-137.82 |
3.54 |
-9.85 |
-0.75 |
0 |
|
|
219417 |
85148634 |
1 |
NSP2O7C20H45 |
ABC2D7E20F45 |
-496.75 |
4.49 |
-8.56 |
0.43 |
0 |
|
|
219418 |
85148635 |
1 |
NF2O3C31H33 |
AB2C3D31E33 |
-149.89 |
2.06 |
-9.08 |
-0.26 |
0 |
|
|
219419 |
85148636 |
1 |
NSO5C29H31 |
ABC5D29E31 |
-133.43 |
4.35 |
-8.85 |
-1.12 |
0 |
|
|
219420 |
85148637 |
1 |
NSO4C30H35 |
ABC4D30E35 |
-138.62 |
5.08 |
-8.53 |
-0.64 |
0 |
|
|
219421 |
85148639 |
1 |
BN2F3O3H26C28 |
AB2C3D3E26F28 |
-304.91 |
5.33 |
-8.52 |
-1.74 |
0 |
|
|
219422 |
85148641 |
1 |
N4O5C28H34 |
A4B5C28D34 |
-168.39 |
5.33 |
-8.75 |
-1.37 |
0 |
|
|
219423 |
85148642 |
1 |
SO6C29H30 |
AB6C29D30 |
-175.44 |
3.74 |
-9.13 |
-0.56 |
0 |
|
|
219424 |
85148643 |
1 |
SN2O5C28H30 |
AB2C5D28E30 |
-111.47 |
6.87 |
-8.81 |
-0.1 |
0 |
|
|
219425 |
85148644 |
1 |
SN4O4C27H30 |
AB4C4D27E30 |
-109.5 |
4.65 |
-8.44 |
-0.62 |
0 |
|
|
219426 |
85148645 |
2 |
NOSH12C15 |
ABCD12E15 |
39.89 |
5.72 |
-8.63 |
-0.92 |
0 |
|
|
219427 |
85148648 |
1 |
SiO4C31H42 |
AB4C31D42 |
-212.29 |
1.26 |
-9.0 |
0.08 |
0 |
|
|
219428 |
85148651 |
1 |
BrH3C10F16 |
AB3C10D16 |
-774.66 |
2.46 |
-11.03 |
-1.3 |
0 |
|
|
219429 |
85148653 |
1 |
BrN2F4O6H13C18 |
AB2C4D6E13F18 |
-377.09 |
6.59 |
-9.32 |
-0.94 |
0 |
|
|
219430 |
85148656 |
1 |
N3O8H25C26 |
A3B8C25D26 |
-279.62 |
7.73 |
-8.65 |
-1.1 |
2 |
|
|
219431 |
85148657 |
1 |
RuCl2S2N3C17H25 |
AB2C2D3E17F25 |
132.53 |
3.35 |
-8.34 |
-2.51 |
0 |
|
|
219432 |
85148660 |
1 |
NSO5C29H33 |
ABC5D29E33 |
-160.37 |
4.58 |
-8.36 |
-0.73 |
0 |
|
|
219433 |
85148661 |
3 |
NO2C9H15 |
AB2C9D15 |
-268.76 |
7.61 |
-9.42 |
0.18 |
0 |
|
|
219434 |
85148663 |
1 |
BrF4O4N5H16C17 |
AB4C4D5E16F17 |
-343.48 |
4.72 |
-8.97 |
-0.63 |
0 |
|
|
219435 |
85148664 |
1 |
BrPSN5O7C14H15 |
ABCD5E7F14G15 |
-250.89 |
5.85 |
-9.27 |
-1.41 |
0 |
|
|
219436 |
85148665 |
1 |
SN4O7C23H32 |
AB4C7D23E32 |
-286.46 |
9.01 |
-8.96 |
-0.9 |
0 |
|
|
219437 |
85148667 |
1 |
O3N4C31H32 |
A3B4C31D32 |
-44.43 |
5.33 |
-8.75 |
-0.24 |
0 |
|
|
219438 |
85148668 |
1 |
SO6C29H32 |
AB6C29D32 |
-185.45 |
4.87 |
-9.18 |
-0.78 |
0 |
|
|
219439 |
85148669 |
2 |
NO3C14H24 |
AB3C14D24 |
-334.55 |
4.95 |
-9.14 |
1.04 |
0 |
|
|
219440 |
85148670 |
1 |
ClSO2N6C25H29 |
ABC2D6E25F29 |
64.15 |
5.66 |
-8.91 |
-0.88 |
0 |
|
|
219441 |
85148672 |
1 |
N3O8C26H27 |
A3B8C26D27 |
-243.82 |
2.79 |
-8.3 |
-0.92 |
0 |
|
|
219442 |
85148673 |
1 |
PbO5C17H20 |
AB5C17D20 |
-176.87 |
6.03 |
-8.64 |
-1.86 |
0 |
|
|
219443 |
85148674 |
1 |
S2N5O5H19C23 |
A2B5C5D19E23 |
-31.82 |
5.21 |
-8.88 |
-1.47 |
0 |
|
|
219444 |
85148678 |
1 |
NO6C30H39 |
AB6C30D39 |
-249.03 |
2.43 |
-9.33 |
0.17 |
0 |
|
|
219445 |
85148680 |
1 |
N3O4C29H55 |
A3B4C29D55 |
-286.46 |
5.99 |
-9.62 |
0.81 |
0 |
|
|
219446 |
85148681 |
1 |
ClNO6C28H28 |
ABC6D28E28 |
-195.88 |
2.8 |
-8.79 |
-0.44 |
1 |
|
|
219447 |
85148683 |
1 |
N3O5C27H28 |
A3B5C27D28 |
-67.5 |
5.05 |
0.0 |
0.0 |
0 |
|
|
219448 |
85148684 |
1 |
O11H22C26 |
A11B22C26 |
-377.62 |
8.55 |
-9.07 |
-1.39 |
0 |
|
|
219449 |
85148685 |
1 |
BrON5C26H30 |
ABC5D26E30 |
62.29 |
4.72 |
-8.72 |
-1.51 |
0 |
|
|
219450 |
85148688 |
1 |
SN4O8C22H30 |
AB4C8D22E30 |
-325.97 |
9.09 |
-9.25 |
-1.27 |
0 |
|
|
219451 |
85148689 |
1 |
N2O7C28H34 |
A2B7C28D34 |
-248.59 |
6.84 |
-9.14 |
-1.29 |
0 |
|
|
219452 |
85148690 |
2 |
NO2C16H17 |
AB2C16D17 |
-100.63 |
6.43 |
-8.3 |
-0.19 |
0 |
|
|
219453 |
85148691 |
2 |
NO2C16H17 |
AB2C16D17 |
-99.81 |
6.54 |
-8.25 |
-0.24 |
0 |
|
|
219454 |
85148692 |
2 |
NO2C16H17 |
AB2C16D17 |
-97.92 |
7.16 |
-8.31 |
-0.12 |
1 |
|
|
219455 |
85148696 |
1 |
PSN2O5C24H52 |
ABC2D5E24F52 |
-344.52 |
4.51 |
0.0 |
0.0 |
0 |
|
|
219456 |
85148698 |
2 |
OC17H35 |
AB17C35 |
-263.33 |
2.74 |
-10.25 |
2.68 |
0 |
|
|
219458 |
85148702 |
1 |
O2N5F6C22H31 |
A2B5C6D22E31 |
-417.02 |
8.33 |
-8.83 |
-0.82 |
0 |
|
|
219459 |
85148703 |
1 |
FSN3O4C27H30 |
ABC3D4E27F30 |
-121.34 |
11.81 |
-8.19 |
-1.06 |
0 |
|
|
219460 |
85148706 |
1 |
O5N9C22H41 |
A5B9C22D41 |
-212.84 |
4.36 |
-9.04 |
-0.15 |
0 |
|
|
219461 |
85148707 |
1 |
SN3O5C27H33 |
AB3C5D27E33 |
-202.54 |
5.33 |
-9.35 |
-0.12 |
0 |
|
|
219462 |
85148708 |
1 |
S4N5H13C25 |
A4B5C13D25 |
282.41 |
6.83 |
-9.21 |
-2.44 |
0 |
|
|
219463 |
85148709 |
1 |
NSiO3C31H49 |
ABC3D31E49 |
-193.2 |
1.51 |
-8.84 |
0.17 |
0 |
|
|
219464 |
85148711 |
1 |
ClN3O6C26H26 |
AB3C6D26E26 |
-207.26 |
2.84 |
-8.54 |
-1.02 |
0 |
|
|
219465 |
85148712 |
1 |
PN2O8C25H27 |
AB2C8D25E27 |
-354.04 |
4.5 |
-8.42 |
-0.52 |
0 |
|
|
219466 |
85148713 |
1 |
N2O9C26H28 |
A2B9C26D28 |
-305.53 |
12.81 |
-8.78 |
-1.94 |
0 |
|
|
219467 |
85148716 |
1 |
FN4O5C27H33 |
AB4C5D27E33 |
-209.33 |
9.18 |
-8.74 |
-1.54 |
1 |
|
|
219468 |
85148718 |
1 |
SN2O7C26H29 |
AB2C7D26E29 |
-184.84 |
1.52 |
0.0 |
0.0 |
0 |
|
|
219469 |
85148719 |
1 |
N2O7C28H36 |
A2B7C28D36 |
-277.52 |
4.28 |
-9.57 |
-0.27 |
0 |
|
|
219470 |
85148720 |
1 |
N2S2O6H24C25 |
A2B2C6D24E25 |
-157.83 |
5.2 |
-8.86 |
-0.67 |
0 |
|
|
219471 |
85148721 |
1 |
FN4O4C28H37 |
AB4C4D28E37 |
-175.34 |
7.72 |
-9.0 |
-0.63 |
0 |
|
|
219472 |
85148726 |
1 |
NPF2S2O9C17H18 |
ABC2D2E9F17G18 |
-463.16 |
2.97 |
-9.14 |
-1.48 |
0 |
|
|
219473 |
85148727 |
1 |
FN5O10C20H26 |
AB5C10D20E26 |
-464.73 |
4.49 |
-9.93 |
-1.12 |
0 |
|
|
219474 |
85148728 |
1 |
O2N5F6H21C23 |
A2B5C6D21E23 |
-274.74 |
7.26 |
-9.01 |
-0.86 |
0 |
|
|
219475 |
85148731 |
1 |
NSiO3C32H39 |
ABC3D32E39 |
-131.66 |
2.42 |
-8.77 |
-0.39 |
0 |
|
|
219476 |
85148732 |
1 |
ClO6N7C21H32 |
AB6C7D21E32 |
-280.33 |
8.46 |
-9.54 |
-0.48 |
0 |
|
|
219477 |
85148734 |
1 |
ClOSN5H24C28 |
ABCD5E24F28 |
118.47 |
6.71 |
-8.13 |
-0.59 |
0 |
|
|
219478 |
85148738 |
1 |
N6O7C24H30 |
A6B7C24D30 |
-103.19 |
3.39 |
-8.82 |
-1.33 |
0 |
|
|
219479 |
85148739 |
1 |
SN2O6H22C28 |
AB2C6D22E28 |
-86.03 |
7.53 |
-8.1 |
-1.46 |
0 |
|
|
219480 |
85148740 |
1 |
N4O7C26H34 |
A4B7C26D34 |
-292.21 |
6.82 |
-9.76 |
-0.39 |
0 |
|
|
219481 |
85148741 |
1 |
SF2N2O4C27H28 |
AB2C2D4E27F28 |
-172.89 |
5.83 |
-8.88 |
-0.63 |
0 |
|
|
219482 |
85148742 |
2 |
N2O2C15H17 |
A2B2C15D17 |
-47.32 |
8.68 |
-8.35 |
-1.42 |
0 |
|
|
219483 |
85148745 |
1 |
ClFN4O6H20C24 |
ABC4D6E20F24 |
-143.83 |
6.66 |
-10.01 |
-1.86 |
0 |
|
|
219484 |
85148747 |
1 |
PbO5C17H26 |
AB5C17D26 |
-208.62 |
7.97 |
-8.22 |
-1.46 |
0 |
|
|
219485 |
85148748 |
1 |
OPbC13H18 |
ABC13D18 |
0.12 |
4.11 |
-8.45 |
-1.62 |
0 |
|
|
219486 |
85148749 |
1 |
NS2O6C26H29 |
AB2C6D26E29 |
-197.23 |
7.9 |
-9.45 |
-1.12 |
0 |
|
|
219487 |
85148750 |
1 |
N3O4C30H49 |
A3B4C30D49 |
-209.47 |
6.87 |
-9.21 |
-0.19 |
0 |
|
|
219488 |
85148751 |
1 |
ClSN3O4H18C27 |
ABC3D4E18F27 |
-11.33 |
5.14 |
-9.03 |
-1.12 |
0 |
|
|
219489 |
85148752 |
1 |
IN2O5C21H29 |
AB2C5D21E29 |
-210.86 |
5.81 |
-9.1 |
-1.07 |
0 |
|
|
219490 |
85148753 |
1 |
O10C27H32 |
A10B27C32 |
-359.25 |
9.75 |
-10.71 |
-0.96 |
0 |