List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
210595 |
80828582 |
1 |
BrSN5C11H14 |
ABC5D11E14 |
60.3 |
4.21 |
-8.57 |
-0.68 |
0 |
|
|
210596 |
80828583 |
1 |
SN5C10H13 |
AB5C10D13 |
60.81 |
2.2 |
-8.72 |
-0.64 |
0 |
|
|
210597 |
80828584 |
1 |
BrN5C15H24 |
AB5C15D24 |
10.48 |
2.8 |
-8.62 |
0.09 |
0 |
|
|
210598 |
80828585 |
1 |
SN4C13H18 |
AB4C13D18 |
45.81 |
2.36 |
-8.18 |
-0.52 |
0 |
|
|
210599 |
80828973 |
1 |
N7C13H25 |
A7B13C25 |
33.33 |
1.76 |
-8.63 |
0.41 |
0 |
|
|
210600 |
80828988 |
1 |
BrN4C12H19 |
AB4C12D19 |
6.29 |
3.55 |
-8.76 |
-0.01 |
0 |
|
|
210601 |
80829054 |
1 |
ClSN6C13H13 |
ABC6D13E13 |
111.9 |
3.53 |
-8.68 |
-1.6 |
0 |
|
|
210602 |
80829491 |
1 |
ON3C13H21 |
AB3C13D21 |
-35.62 |
1.49 |
-8.18 |
0.57 |
0 |
|
|
210603 |
80829492 |
1 |
N4C17H28 |
A4B17C28 |
36.07 |
3.85 |
-8.53 |
0.31 |
0 |
|
|
210604 |
80829493 |
2 |
ON2C7H9 |
AB2C7D9 |
-22.91 |
7.75 |
-8.76 |
0.1 |
0 |
|
|
210605 |
80829494 |
1 |
ON5C13H17 |
AB5C13D17 |
1.68 |
2.16 |
-9.01 |
0.24 |
0 |
|
|
210606 |
80829495 |
1 |
N5C12H21 |
A5B12C21 |
18.61 |
3.38 |
-8.68 |
0.29 |
0 |
|
|
210607 |
80829496 |
1 |
N5C13H23 |
A5B13C23 |
19.44 |
4.43 |
-8.63 |
0.41 |
0 |
|
|
210608 |
80829986 |
1 |
ON5C14H21 |
AB5C14D21 |
0.99 |
4.72 |
-8.13 |
-0.08 |
0 |
|
|
210609 |
80829987 |
1 |
ON4C9H14 |
AB4C9D14 |
-15.61 |
3.1 |
-8.9 |
0.16 |
0 |
|
|
210610 |
80829988 |
1 |
F3N4C14H21 |
A3B4C14D21 |
-160.24 |
2.48 |
-8.68 |
0.36 |
0 |
|
|
210611 |
80830555 |
1 |
BrO2N5C13H16 |
AB2C5D13E16 |
-25.59 |
1.86 |
-8.89 |
-0.5 |
0 |
|
|
210612 |
80830556 |
1 |
BrON4C15H19 |
ABC4D15E19 |
1.03 |
4.53 |
-8.55 |
-0.28 |
0 |
|
|
210613 |
80830557 |
6 |
NC2H3 |
AB2C3 |
59.32 |
6.58 |
-8.62 |
0.33 |
0 |
|
|
210614 |
80830558 |
6 |
NC2H3 |
AB2C3 |
60.85 |
3.43 |
-8.69 |
0.14 |
0 |
|
|
210615 |
80830894 |
1 |
ClN7C11H16 |
AB7C11D16 |
67.24 |
3.41 |
-9.2 |
-0.32 |
0 |
|
|
210616 |
80830904 |
4 |
NC4H7 |
AB4C7 |
-4.66 |
2.62 |
-8.68 |
0.11 |
0 |
|
|
210617 |
80830905 |
1 |
N4C15H26 |
A4B15C26 |
-8.42 |
3.23 |
-8.43 |
0.59 |
0 |
|
|
210618 |
80831335 |
2 |
N2C8H11 |
A2B8C11 |
29.02 |
2.17 |
-8.51 |
0.4 |
0 |
|
|
210619 |
80831336 |
2 |
N3C7H10 |
A3B7C10 |
59.56 |
3.83 |
-8.84 |
-0.08 |
0 |
|
|
210620 |
80831337 |
1 |
N6C13H18 |
A6B13C18 |
70.76 |
0.98 |
-8.83 |
-0.03 |
0 |
|
|
210621 |
80831338 |
1 |
N7C13H19 |
A7B13C19 |
60.81 |
6.67 |
-8.84 |
0.31 |
0 |
|
|
210622 |
80831620 |
1 |
N5C14H25 |
A5B14C25 |
11.15 |
4.89 |
-8.7 |
0.38 |
0 |
|
|
210623 |
80831848 |
1 |
O2N6C11H14 |
A2B6C11D14 |
56.37 |
8.92 |
-9.15 |
-0.92 |
0 |
|
|
210624 |
80831941 |
1 |
ON6C14H24 |
AB6C14D24 |
-16.79 |
3.77 |
-8.95 |
0.42 |
0 |
|
|
210625 |
80831942 |
1 |
N5C14H25 |
A5B14C25 |
17.17 |
5.43 |
-8.62 |
0.24 |
0 |
|
|
210626 |
80831943 |
1 |
SN5C14H25 |
AB5C14D25 |
12.94 |
3.61 |
-8.44 |
0.25 |
0 |
|
|
210627 |
80831944 |
1 |
N5C12H21 |
A5B12C21 |
19.14 |
2.94 |
-8.53 |
0.54 |
0 |
|
|
210628 |
80832064 |
1 |
BrON4C12H19 |
ABC4D12E19 |
-34.05 |
3.04 |
-8.77 |
-0.06 |
0 |
|
|
210629 |
80832065 |
1 |
ON4C11H18 |
AB4C11D18 |
-32.02 |
1.69 |
-8.66 |
0.14 |
0 |
|
|
210630 |
80832066 |
1 |
ON6C14H26 |
AB6C14D26 |
-29.68 |
2.55 |
-8.83 |
0.56 |
0 |
|
|
210631 |
80832113 |
1 |
N5C12H23 |
A5B12C23 |
20.72 |
3.84 |
-8.68 |
0.07 |
0 |
|
|
210632 |
80832192 |
1 |
OSN4C13H22 |
ABC4D13E22 |
-37.01 |
4.74 |
-8.64 |
-0.01 |
0 |
|
|
210633 |
80832193 |
1 |
ON4C13H22 |
AB4C13D22 |
-39.57 |
4.25 |
-9.06 |
0.08 |
0 |
|
|
210634 |
80832194 |
1 |
ON5C12H21 |
AB5C12D21 |
-44.01 |
1.77 |
-8.91 |
0.37 |
0 |
|
|
210635 |
80832195 |
1 |
N3O3C14H21 |
A3B3C14D21 |
-68.34 |
4.49 |
-8.64 |
-0.8 |
0 |
|
|
210636 |
80832666 |
3 |
ON2C4H6 |
AB2C4D6 |
-88.02 |
6.66 |
-9.68 |
-0.33 |
0 |
|
|
210637 |
80832800 |
1 |
ON4C15H26 |
AB4C15D26 |
-54.78 |
4.89 |
-8.89 |
0.06 |
0 |
|
|
210638 |
80832949 |
1 |
ON6C12H24 |
AB6C12D24 |
-13.88 |
3.86 |
-8.87 |
0.46 |
0 |
|
|
210639 |
80833026 |
1 |
ClF2N5H10C11 |
AB2C5D10E11 |
-33.83 |
4.25 |
-9.76 |
-0.56 |
0 |
|
|
210640 |
80833027 |
2 |
FN2C7H8 |
AB2C7D8 |
-44.5 |
1.76 |
-8.59 |
-0.55 |
0 |
|
|
210641 |
80833028 |
5 |
NC3H3 |
AB3C3 |
79.39 |
4.03 |
-8.57 |
-0.69 |
0 |
|
|
210642 |
80833029 |
1 |
N5H13C14 |
A5B13C14 |
86.29 |
1.99 |
-8.73 |
-0.94 |
0 |
|
|
210643 |
80833155 |
1 |
N5C11H19 |
A5B11C19 |
28.28 |
4.09 |
-8.73 |
0.34 |
0 |
|
|
210644 |
80833711 |
1 |
BrO2S2N4C12H19 |
AB2C2D4E12F19 |
-46.71 |
6.39 |
-8.96 |
-0.53 |
0 |
|
|
210645 |
80833712 |
1 |
O2S2N6C11H20 |
A2B2C6D11E20 |
-38.01 |
7.64 |
-8.56 |
-0.15 |
0 |
|
|
210646 |
80833713 |
1 |
N5C11H19 |
A5B11C19 |
12.29 |
3.15 |
-8.41 |
0.69 |
0 |
|
|
210647 |
80833714 |
2 |
N2C7H12 |
A2B7C12 |
4.03 |
3.74 |
-8.64 |
0.34 |
0 |
|
|
210648 |
80833925 |
1 |
N4C15H18 |
A4B15C18 |
48.29 |
2.83 |
-8.42 |
-0.11 |
0 |
|
|
210649 |
80834320 |
1 |
ClF3N4H10C12 |
AB3C4D10E12 |
-118.78 |
4.01 |
-9.15 |
-0.97 |
0 |
|
|
210650 |
80834615 |
1 |
ON6C14H24 |
AB6C14D24 |
-5.71 |
1.87 |
-8.8 |
0.53 |
0 |
|
|
210651 |
80834675 |
1 |
ON5C15H25 |
AB5C15D25 |
-26.07 |
4.63 |
-8.62 |
0.5 |
0 |
|
|
210652 |
80834938 |
1 |
FN4C12H21 |
AB4C12D21 |
-39.02 |
3.07 |
-8.59 |
0.11 |
0 |
|
|
210653 |
80835818 |
1 |
O2N3C14H21 |
A2B3C14D21 |
-4.17 |
7.99 |
-8.44 |
-0.89 |
0 |
|
|
210654 |
80835825 |
1 |
O2N3C15H23 |
A2B3C15D23 |
-8.42 |
3.24 |
-8.21 |
-0.57 |
0 |
|
|
210655 |
80835927 |
1 |
FON4H11C12 |
ABC4D11E12 |
-13.93 |
1.63 |
-9.05 |
-0.28 |
0 |
|
|
210656 |
80835928 |
1 |
ClON4C14H15 |
ABC4D14E15 |
12.14 |
3.01 |
-8.68 |
-0.18 |
0 |
|
|
210657 |
80836469 |
1 |
ON6C14H22 |
AB6C14D22 |
-16.61 |
6.53 |
-8.58 |
0.22 |
0 |
|
|
210658 |
80836756 |
1 |
BrSN4C12H15 |
ABC4D12E15 |
54.71 |
2.08 |
-8.8 |
-0.71 |
0 |
|
|
210659 |
80836757 |
1 |
BrSN4C10H11 |
ABC4D10E11 |
69.12 |
4.04 |
-9.18 |
-0.67 |
0 |
|
|
210660 |
80836758 |
1 |
BrSN4C11H13 |
ABC4D11E13 |
65.5 |
3.58 |
-8.92 |
-0.71 |
0 |
|
|
210661 |
80836759 |
1 |
ON6C14H26 |
AB6C14D26 |
-22.07 |
2.2 |
-8.91 |
0.42 |
0 |
|
|
210662 |
80836760 |
1 |
N5C16H27 |
A5B16C27 |
23.8 |
2.71 |
-7.98 |
0.02 |
0 |
|
|
210663 |
80836761 |
1 |
O2N4C15H26 |
A2B4C15D26 |
-18.17 |
6.93 |
-8.82 |
-0.57 |
0 |
|
|
210664 |
80836762 |
1 |
BrClSN4H8C9 |
ABCD4E8F9 |
69.55 |
2.26 |
-8.81 |
-0.89 |
0 |
|
|
210665 |
80836763 |
1 |
BrSN6C10H13 |
ABC6D10E13 |
83.37 |
1.87 |
-9.05 |
-0.77 |
0 |
|
|
210666 |
80836764 |
1 |
SO2N5C13H17 |
AB2C5D13E17 |
49.34 |
4.08 |
-8.64 |
-0.87 |
0 |
|
|
210667 |
80837570 |
1 |
N5C12H21 |
A5B12C21 |
19.22 |
2.62 |
-8.6 |
0.38 |
0 |
|
|
210668 |
80837571 |
1 |
O2N5C10H15 |
A2B5C10D15 |
27.94 |
6.9 |
-8.92 |
-0.67 |
0 |
|
|
210669 |
80837572 |
1 |
SO4N5C11H19 |
AB4C5D11E19 |
-85.66 |
3.99 |
-9.57 |
-1.1 |
0 |