List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
296400 |
117571833 |
2 |
ClNC6H8 |
ABC6D8 |
4.93 |
2.77 |
-8.52 |
-0.3 |
0 |
|
|
296401 |
117571836 |
2 |
ClNC6H8 |
ABC6D8 |
7.89 |
2.57 |
-8.61 |
-0.22 |
0 |
|
|
296402 |
117571847 |
1 |
N2C11H24 |
A2B11C24 |
-19.52 |
3.17 |
-8.41 |
2.72 |
0 |
|
|
296403 |
117571849 |
1 |
N2C11H24 |
A2B11C24 |
-20.16 |
3.07 |
-8.37 |
2.73 |
0 |
|
|
296404 |
117571855 |
1 |
ON2C10H22 |
AB2C10D22 |
-43.08 |
2.89 |
-8.55 |
2.24 |
0 |
|
|
296405 |
117571916 |
1 |
ClN2C13H19 |
AB2C13D19 |
10.64 |
5.99 |
-8.16 |
0.39 |
0 |
|
|
296406 |
117571978 |
2 |
NOC6H8 |
ABC6D8 |
-49.3 |
1.85 |
-9.73 |
-0.33 |
0 |
|
|
296407 |
117572250 |
1 |
NO3C14H19 |
AB3C14D19 |
-99.44 |
1.54 |
-8.05 |
0.18 |
0 |
|
|
296408 |
117572264 |
2 |
NOC7H8 |
ABC7D8 |
-29.33 |
4.6 |
-8.86 |
-0.58 |
0 |
|
|
296409 |
117572310 |
1 |
NO2C13H17 |
AB2C13D17 |
-57.23 |
0.13 |
-8.24 |
0.39 |
0 |
|
|
296410 |
117572352 |
1 |
NO3C14H19 |
AB3C14D19 |
-93.15 |
1.64 |
-7.96 |
0.38 |
0 |
|
|
296411 |
117572723 |
2 |
NOC5H10 |
ABC5D10 |
-75.68 |
3.54 |
-8.66 |
1.82 |
0 |
|
|
296412 |
117573069 |
1 |
NO3C15H23 |
AB3C15D23 |
-136.18 |
5.52 |
-8.04 |
0.19 |
0 |
|
|
296413 |
117573102 |
1 |
ON2C11H24 |
AB2C11D24 |
-68.65 |
2.06 |
-8.18 |
2.63 |
0 |
|
|
296414 |
117573184 |
1 |
NO3C13H19 |
AB3C13D19 |
-123.49 |
3.94 |
-8.71 |
-0.57 |
0 |
|
|
296415 |
117573186 |
1 |
FNOC11H16 |
ABCD11E16 |
-89.34 |
4.17 |
-8.7 |
0.12 |
0 |
|
|
296416 |
117573190 |
1 |
BrNOC12H18 |
ABCD12E18 |
-46.09 |
3.57 |
-8.47 |
0.06 |
0 |
|
|
296417 |
117573326 |
1 |
ON2C16H24 |
AB2C16D24 |
-30.29 |
3.15 |
-8.41 |
0.03 |
0 |
|
|
296418 |
117573410 |
2 |
NC8H14 |
AB8C14 |
-17.41 |
2.36 |
-8.22 |
0.62 |
0 |
|
|
296419 |
117573657 |
1 |
NSO4C11H21 |
ABC4D11E21 |
-195.77 |
5.21 |
-9.65 |
0.55 |
0 |
|
|
296420 |
117573686 |
1 |
ClNO2C13H18 |
ABC2D13E18 |
-93.12 |
3.99 |
-8.33 |
0.17 |
0 |
|
|
296421 |
117573722 |
2 |
NC5H9 |
AB5C9 |
2.19 |
3.43 |
-9.15 |
1.25 |
0 |
|
|
296422 |
117573732 |
1 |
N3C10H21 |
A3B10C21 |
9.87 |
3.83 |
-8.76 |
1.34 |
0 |
|
|
296423 |
117573733 |
1 |
N3C10H19 |
A3B10C19 |
13.55 |
3.79 |
-8.48 |
1.59 |
0 |
|
|
296424 |
117573734 |
1 |
N3C11H21 |
A3B11C21 |
8.34 |
3.88 |
-8.41 |
1.43 |
0 |
|
|
296425 |
117573735 |
1 |
ON3C10H17 |
AB3C10D17 |
-22.37 |
2.99 |
-9.06 |
0.69 |
0 |
|
|
296426 |
117573736 |
1 |
ON3C11H19 |
AB3C11D19 |
-35.06 |
2.77 |
-8.96 |
0.88 |
0 |
|
|
296427 |
117573737 |
1 |
ON2C10H14 |
AB2C10D14 |
8.63 |
3.55 |
-9.34 |
0.44 |
0 |
|
|
296428 |
117573740 |
1 |
N2C13H18 |
A2B13C18 |
34.8 |
3.53 |
-9.23 |
0.28 |
0 |
|
|
296429 |
117573742 |
1 |
N2O2C13H16 |
A2B2C13D16 |
-24.02 |
3.47 |
-8.75 |
-0.1 |
0 |
|
|
296430 |
117573747 |
1 |
N2C13H18 |
A2B13C18 |
34.74 |
3.35 |
-9.28 |
0.3 |
0 |
|
|
296431 |
117573764 |
1 |
N2C17H24 |
A2B17C24 |
21.2 |
3.69 |
-8.93 |
0.33 |
0 |
|
|
296432 |
117573769 |
2 |
NC6H8 |
AB6C8 |
30.09 |
3.18 |
-8.3 |
0.34 |
0 |
|
|
296433 |
117573958 |
1 |
N2O2C13H16 |
A2B2C13D16 |
-30.7 |
3.4 |
-8.24 |
-0.04 |
0 |
|
|
296434 |
117574042 |
1 |
FN2C12H19 |
AB2C12D19 |
-38.46 |
3.18 |
-8.47 |
0.11 |
0 |
|
|
296435 |
117574189 |
1 |
N3C16H27 |
A3B16C27 |
3.18 |
4.26 |
-8.3 |
0.6 |
0 |
|
|
296436 |
117574320 |
1 |
N3C16H27 |
A3B16C27 |
2.79 |
3.18 |
-7.88 |
0.64 |
0 |
|
|
296437 |
117574410 |
1 |
ON4C14H28 |
AB4C14D28 |
-55.11 |
3.84 |
-8.56 |
1.01 |
0 |
|
|
296438 |
117574463 |
1 |
N3O3C9H17 |
A3B3C9D17 |
-120.78 |
3.54 |
-9.21 |
0.52 |
0 |
|
|
296439 |
117574467 |
2 |
NOC6H9 |
ABC6D9 |
-72.41 |
5.05 |
-9.07 |
0.44 |
0 |
|
|
296440 |
117574486 |
1 |
N2O2C11H16 |
A2B2C11D16 |
-72.48 |
5.19 |
-8.39 |
0.27 |
0 |
|
|
296441 |
117574498 |
1 |
N2O2C13H20 |
A2B2C13D20 |
-85.79 |
4.23 |
-8.43 |
0.48 |
0 |
|
|
296442 |
117574503 |
1 |
FN2O2C10H13 |
AB2C2D10E13 |
-104.46 |
5.64 |
-9.03 |
-0.24 |
0 |
|
|
296443 |
117574590 |
1 |
ClNO2F3H9C10 |
ABC2D3E9F10 |
-229.43 |
3.33 |
-9.16 |
-1.11 |
0 |
|
|
296444 |
117574591 |
1 |
NOC7H15 |
ABC7D15 |
-61.56 |
1.23 |
-9.18 |
2.07 |
0 |
|
|
296445 |
117574614 |
1 |
NOC9H19 |
ABC9D19 |
-69.81 |
1.34 |
-9.17 |
2.09 |
0 |
|
|
296446 |
117574623 |
1 |
NOC11H17 |
ABC11D17 |
-37.07 |
2.59 |
-8.33 |
0.56 |
0 |
|
|
296447 |
117574721 |
1 |
N3C7H17 |
A3B7C17 |
5.29 |
1.26 |
-8.44 |
2.62 |
0 |
|
|
296448 |
117574752 |
1 |
ClN3C8H12 |
AB3C8D12 |
25.85 |
2.41 |
-8.67 |
-0.05 |
0 |
|
|
296449 |
117574818 |
1 |
BrON2C6H11 |
ABC2D6E11 |
-45.46 |
3.0 |
-9.03 |
-0.21 |
0 |
|
|
296450 |
117575013 |
1 |
BrClNC7H7 |
ABCD7E7 |
9.89 |
1.26 |
-9.1 |
-0.31 |
0 |
|
|
296451 |
117575032 |
1 |
N5C8H15 |
A5B8C15 |
26.13 |
3.51 |
-8.85 |
0.29 |
0 |
|
|
296452 |
117575180 |
1 |
N5C11H19 |
A5B11C19 |
35.48 |
4.03 |
-8.73 |
0.3 |
0 |
|
|
296453 |
117575283 |
1 |
N5C12H23 |
A5B12C23 |
4.82 |
2.36 |
-8.83 |
0.27 |
0 |
|
|
296454 |
117575462 |
1 |
FN5C13H14 |
AB5C13D14 |
34.95 |
4.64 |
-8.84 |
-0.45 |
0 |
|
|
296455 |
117575463 |
1 |
BrN5C13H14 |
AB5C13D14 |
83.96 |
4.78 |
-8.83 |
-0.58 |
0 |
|
|
296456 |
117575608 |
1 |
N5C14H25 |
A5B14C25 |
1.16 |
4.25 |
-8.88 |
0.18 |
0 |
|
|
296457 |
117575834 |
1 |
O3N4C11H18 |
A3B4C11D18 |
-100.88 |
8.04 |
-9.08 |
0.03 |
0 |
|
|
296458 |
117575837 |
1 |
O2N5C12H21 |
A2B5C12D21 |
-59.77 |
7.46 |
-8.92 |
0.12 |
0 |
|
|
296459 |
117575920 |
1 |
SN5C11H21 |
AB5C11D21 |
26.31 |
2.88 |
-8.93 |
0.12 |
0 |
|
|
296460 |
117575924 |
1 |
OSN4C11H14 |
ABC4D11E14 |
25.31 |
1.9 |
-9.16 |
-0.05 |
0 |
|
|
296461 |
117576054 |
1 |
N5H11C12 |
A5B11C12 |
108.13 |
2.91 |
-9.01 |
-0.48 |
0 |
|
|
296462 |
117576283 |
2 |
N3C6H10 |
A3B6C10 |
52.42 |
6.75 |
-8.89 |
0.2 |
0 |
|
|
296463 |
117576285 |
1 |
N6C13H20 |
A6B13C20 |
58.26 |
6.44 |
-8.7 |
0.08 |
0 |
|
|
296464 |
117576552 |
1 |
ON4C14H24 |
AB4C14D24 |
-43.61 |
2.92 |
-8.72 |
0.3 |
0 |
|
|
296465 |
117576680 |
1 |
N5C13H19 |
A5B13C19 |
42.09 |
4.71 |
-8.82 |
0.21 |
0 |
|
|
296466 |
117576686 |
1 |
N5C14H19 |
A5B14C19 |
54.6 |
5.68 |
-8.72 |
0.2 |
0 |
|
|
296467 |
117576777 |
1 |
ON5C13H23 |
AB5C13D23 |
-19.04 |
4.72 |
-8.77 |
0.26 |
0 |
|
|
296468 |
117576780 |
1 |
O2N5C12H21 |
A2B5C12D21 |
-46.22 |
4.0 |
-8.8 |
0.13 |
0 |
|
|
296469 |
117576782 |
1 |
ON5C13H23 |
AB5C13D23 |
-26.5 |
2.32 |
-8.8 |
0.21 |
0 |
|
|
296470 |
117576809 |
1 |
N5C13H23 |
A5B13C23 |
14.18 |
4.01 |
-8.68 |
0.29 |
0 |
|
|
296471 |
117576840 |
1 |
N5C15H19 |
A5B15C19 |
60.72 |
3.41 |
-8.55 |
-0.19 |
0 |
|
|
296472 |
117576917 |
1 |
O2N4C13H20 |
A2B4C13D20 |
-56.89 |
4.82 |
-8.91 |
0.01 |
0 |
|
|
296473 |
117576966 |
1 |
ON5C13H23 |
AB5C13D23 |
-18.03 |
4.22 |
-8.75 |
0.22 |
0 |
|
|
296474 |
117577089 |
1 |
N5C12H21 |
A5B12C21 |
32.72 |
4.48 |
-8.59 |
0.35 |
0 |
|
|
296475 |
117577094 |
1 |
N5C14H25 |
A5B14C25 |
12.46 |
3.26 |
-8.61 |
0.37 |
0 |
|
|
296476 |
117577101 |
1 |
O2N4C11H16 |
A2B4C11D16 |
-64.18 |
9.17 |
-9.15 |
-0.15 |
0 |
|
|
296477 |
117577103 |
2 |
ON2C6H9 |
AB2C6D9 |
-58.4 |
2.48 |
-8.82 |
0.14 |
0 |
|
|
296478 |
117577537 |
2 |
ON2C6H10 |
AB2C6D10 |
-72.78 |
3.01 |
-8.76 |
0.23 |
0 |
|
|
296479 |
117577550 |
1 |
O2N4C13H20 |
A2B4C13D20 |
-61.35 |
5.92 |
-8.81 |
0.16 |
0 |
|
|
296480 |
117577572 |
1 |
ON5C11H15 |
AB5C11D15 |
27.11 |
2.37 |
-9.32 |
-0.5 |
0 |
|
|
296481 |
117577681 |
1 |
N5C12H19 |
A5B12C19 |
46.19 |
5.17 |
-9.06 |
-0.03 |
0 |
|
|
296482 |
117577694 |
1 |
N5C15H17 |
A5B15C17 |
79.59 |
2.78 |
-8.68 |
-0.26 |
0 |
|
|
296483 |
117577847 |
1 |
ON5C13H23 |
AB5C13D23 |
-21.36 |
4.81 |
-8.78 |
0.16 |
0 |
|
|
296484 |
117577877 |
1 |
N5C13H23 |
A5B13C23 |
4.7 |
2.53 |
-8.55 |
0.53 |
0 |
|
|
296485 |
117578110 |
1 |
N5C11H17 |
A5B11C17 |
61.38 |
3.67 |
-8.94 |
0.18 |
0 |
|
|
296486 |
117578208 |
1 |
N5C11H19 |
A5B11C19 |
19.14 |
1.76 |
-8.93 |
0.31 |
0 |
|
|
296487 |
117578299 |
1 |
O2N4C13H22 |
A2B4C13D22 |
-94.51 |
4.76 |
-8.91 |
0.29 |
0 |
|
|
296488 |
117578314 |
1 |
O2N4C9H14 |
A2B4C9D14 |
-65.79 |
3.48 |
-9.2 |
0.03 |
0 |
|
|
296489 |
117578343 |
1 |
O2N4C13H22 |
A2B4C13D22 |
-92.77 |
2.23 |
-8.8 |
0.37 |
0 |
|
|
296490 |
117578355 |
1 |
O2N4C13H20 |
A2B4C13D20 |
-68.54 |
7.77 |
-9.18 |
-0.12 |
0 |
|
|
296491 |
117578380 |
1 |
O2N4C11H16 |
A2B4C11D16 |
-43.71 |
8.34 |
-9.14 |
-0.14 |
0 |
|
|
296492 |
117578457 |
1 |
N5C14H27 |
A5B14C27 |
-9.3 |
2.62 |
-8.54 |
0.59 |
0 |
|
|
296493 |
117578517 |
1 |
N5H13C14 |
A5B13C14 |
94.68 |
2.37 |
-8.57 |
-0.44 |
0 |
|
|
296494 |
117579085 |
1 |
N5C14H25 |
A5B14C25 |
4.95 |
1.69 |
-8.57 |
0.51 |
0 |
|
|
296495 |
117579103 |
1 |
N5C13H23 |
A5B13C23 |
11.47 |
2.61 |
-8.47 |
0.59 |
0 |
|
|
296496 |
117579153 |
1 |
N4C13H22 |
A4B13C22 |
-3.54 |
2.56 |
-8.64 |
0.45 |
0 |
|
|
296497 |
117579608 |
1 |
SO2N3C11H17 |
AB2C3D11E17 |
-53.64 |
5.2 |
-9.4 |
-0.32 |
0 |
|
|
296498 |
117579671 |
1 |
SO2N3C10H17 |
AB2C3D10E17 |
-68.86 |
3.77 |
-8.76 |
0.02 |
0 |
|
|
296499 |
117579780 |
1 |
N2O3C11H14 |
A2B3C11D14 |
-90.67 |
3.64 |
-8.53 |
-0.56 |
0 |