List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
272900 |
103764349 |
1 |
BrClON2C15H20 |
ABCD2E15F20 |
-41.15 |
4.02 |
-8.71 |
-0.88 |
0 |
|
|
272901 |
103764374 |
2 |
NO2C6H8 |
AB2C6D8 |
-155.18 |
3.6 |
-9.53 |
-0.91 |
0 |
|
|
272902 |
103764420 |
1 |
ClNO5C10H12 |
ABC5D10E12 |
-113.82 |
4.61 |
-9.75 |
-1.52 |
0 |
|
|
272903 |
103764753 |
1 |
SO2N3C12H17 |
AB2C3D12E17 |
-3.68 |
6.54 |
-8.77 |
-1.07 |
0 |
|
|
272904 |
103764854 |
1 |
N2O3H12C14 |
A2B3C12D14 |
-70.88 |
5.42 |
-9.15 |
-1.01 |
0 |
|
|
272905 |
103764855 |
1 |
BrClNO2H11C15 |
ABCD2E11F15 |
-37.81 |
2.35 |
-9.07 |
-1.13 |
0 |
|
|
272906 |
103764916 |
1 |
N2O2C17H24 |
A2B2C17D24 |
-88.54 |
7.06 |
-8.93 |
-0.52 |
0 |
|
|
272907 |
103764917 |
1 |
SN2O2C15H20 |
AB2C2D15E20 |
-49.92 |
8.58 |
-9.71 |
-1.06 |
0 |
|
|
272908 |
103764925 |
1 |
BrClNO2C13H15 |
ABCD2E13F15 |
-83.29 |
2.3 |
-9.69 |
-1.05 |
0 |
|
|
272909 |
103764971 |
1 |
BrClN2O3H12C14 |
ABC2D3E12F14 |
-84.4 |
5.05 |
-9.27 |
-1.12 |
0 |
|
|
272910 |
103765224 |
1 |
BrClNOC13H17 |
ABCDE13F17 |
-59.98 |
3.45 |
-9.56 |
-0.92 |
0 |
|
|
272911 |
103765475 |
1 |
BrClON2C15H20 |
ABCD2E15F20 |
-37.78 |
4.43 |
-8.66 |
-0.87 |
0 |
|
|
272912 |
103765609 |
1 |
FNO2C15H20 |
ABC2D15E20 |
-138.96 |
6.28 |
-9.32 |
-0.33 |
0 |
|
|
272913 |
103765631 |
1 |
BrClNO3C14H15 |
ABCD3E14F15 |
-121.5 |
3.61 |
-9.46 |
-1.0 |
0 |
|
|
272914 |
103765728 |
1 |
ClN2O2S2C12H15 |
AB2C2D2E12F15 |
-18.02 |
4.03 |
-9.68 |
-1.44 |
0 |
|
|
272915 |
103765750 |
1 |
NSO2C10H17 |
ABC2D10E17 |
-56.11 |
3.75 |
-9.58 |
0.51 |
0 |
|
|
272916 |
103765836 |
1 |
O2N3C15H21 |
A2B3C15D21 |
-80.31 |
4.73 |
-8.76 |
-0.79 |
0 |
|
|
272917 |
103765897 |
1 |
N2O3C17H32 |
A2B3C17D32 |
-153.04 |
3.51 |
-9.06 |
1.05 |
0 |
|
|
272918 |
103766434 |
1 |
N2O2C15H24 |
A2B2C15D24 |
-92.91 |
3.04 |
-9.98 |
0.49 |
0 |
|
|
272919 |
103766589 |
1 |
ON3C13H21 |
AB3C13D21 |
-38.43 |
6.42 |
-9.53 |
0.22 |
0 |
|
|
272920 |
103766620 |
1 |
NOC10H23 |
ABC10D23 |
-90.2 |
1.99 |
-8.96 |
2.66 |
0 |
|
|
272921 |
103766643 |
1 |
ClIN2O3H10C14 |
ABC2D3E10F14 |
3.42 |
2.5 |
-9.33 |
-1.79 |
0 |
|
|
272922 |
103766717 |
1 |
INOCl3H7C13 |
ABCD3E7F13 |
-1.02 |
3.18 |
-9.15 |
-1.35 |
0 |
|
|
272923 |
103766727 |
1 |
ClINO2H13C15 |
ABCD2E13F15 |
-34.6 |
5.36 |
-8.92 |
-1.21 |
0 |
|
|
272924 |
103767562 |
1 |
ClNSO3C15H22 |
ABCD3E15F22 |
-137.28 |
3.46 |
-9.0 |
-0.2 |
0 |
|
|
272925 |
103767574 |
1 |
SN3O3C13H21 |
AB3C3D13E21 |
-108.34 |
3.82 |
-9.0 |
-0.95 |
0 |
|
|
272926 |
103767681 |
1 |
N3O3C14H17 |
A3B3C14D17 |
-96.5 |
5.9 |
-8.75 |
-0.26 |
0 |
|
|
272927 |
103767852 |
1 |
SN2O3C13H20 |
AB2C3D13E20 |
-146.74 |
6.58 |
-8.49 |
-0.66 |
0 |
|
|
272928 |
103767913 |
1 |
NO2C14H19 |
AB2C14D19 |
-93.88 |
5.22 |
-9.37 |
-0.01 |
0 |
|
|
272929 |
103767914 |
1 |
N2O2C15H22 |
A2B2C15D22 |
-84.19 |
2.89 |
-8.94 |
-0.06 |
0 |
|
|
272930 |
103767915 |
1 |
NO2C14H19 |
AB2C14D19 |
-95.23 |
2.66 |
-9.46 |
-0.03 |
0 |
|
|
272931 |
103767950 |
1 |
ClNO3C14H18 |
ABC3D14E18 |
-155.39 |
4.33 |
-8.7 |
-0.03 |
0 |
|
|
272932 |
103767989 |
1 |
ClNO2C10H12 |
ABC2D10E12 |
-79.85 |
4.06 |
-8.56 |
0.09 |
0 |
|
|
272933 |
103768007 |
1 |
ClSN2C12H13 |
ABC2D12E13 |
31.59 |
2.61 |
-8.38 |
-0.54 |
0 |
|
|
272934 |
103768137 |
1 |
SO2N4C14H16 |
AB2C4D14E16 |
-3.18 |
4.08 |
-8.97 |
-1.37 |
0 |
|
|
272935 |
103768141 |
1 |
SO2N5C11H11 |
AB2C5D11E11 |
25.6 |
1.31 |
-9.99 |
-1.54 |
0 |
|
|
272936 |
103768180 |
2 |
NOC6H11 |
ABC6D11 |
-113.18 |
3.62 |
-9.36 |
1.19 |
0 |
|
|
272937 |
103768302 |
1 |
ClSN2O2H13C15 |
ABC2D2E13F15 |
-17.36 |
7.39 |
-9.18 |
-1.1 |
0 |
|
|
272938 |
103768402 |
1 |
ClN2O3C13H17 |
AB2C3D13E17 |
-56.6 |
8.96 |
-9.12 |
-1.12 |
0 |
|
|
272939 |
103768410 |
1 |
FON2C14H17 |
ABC2D14E17 |
-56.95 |
4.63 |
-9.03 |
-0.65 |
0 |
|
|
272940 |
103768432 |
1 |
ON4C11H18 |
AB4C11D18 |
-16.33 |
2.21 |
-8.63 |
-0.36 |
0 |
|
|
272941 |
103768443 |
1 |
FN2O3C13H17 |
AB2C3D13E17 |
-94.82 |
5.53 |
-9.06 |
-1.33 |
0 |
|
|
272942 |
103768444 |
1 |
N2O3C15H22 |
A2B3C15D22 |
-126.27 |
5.04 |
-9.02 |
-0.5 |
0 |
|
|
272943 |
103768450 |
1 |
O3N4C12H20 |
A3B4C12D20 |
-92.72 |
4.18 |
-9.52 |
0.01 |
0 |
|
|
272944 |
103768508 |
1 |
ON5C13H19 |
AB5C13D19 |
17.09 |
6.9 |
-9.17 |
-0.56 |
0 |
|
|
272945 |
103768563 |
1 |
SBr2N3O3C11H11 |
AB2C3D3E11F11 |
-65.1 |
7.88 |
-8.94 |
-0.93 |
0 |
|
|
272946 |
103768564 |
2 |
BrNOSC6H6 |
ABCDE6F6 |
-59.15 |
7.7 |
-8.72 |
-1.02 |
0 |
|
|
272947 |
103768572 |
1 |
SBr2N2O2C14H14 |
AB2C2D2E14F14 |
-22.2 |
5.94 |
-9.37 |
-1.26 |
0 |
|
|
272948 |
103768573 |
1 |
BrN2O2S2C11H11 |
AB2C2D2E11F11 |
-7.88 |
4.63 |
-9.4 |
-1.47 |
0 |
|
|
272949 |
103768606 |
1 |
SN2O3C15H20 |
AB2C3D15E20 |
-91.45 |
5.45 |
-9.85 |
-1.11 |
0 |