List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
372967 |
131307646 |
1 |
FNOH12C13 |
ABCD12E13 |
-36.16 |
1.16 |
-10.15 |
-0.62 |
0 |
|
|
372968 |
131307665 |
1 |
BrClNSO2H5C9 |
ABCDE2F5G9 |
29.22 |
4.68 |
-9.4 |
-1.82 |
0 |
|
|
372969 |
131307677 |
1 |
BrClSF2H6C10 |
ABCD2E6F10 |
-75.5 |
3.78 |
-9.06 |
-1.3 |
0 |
|
|
372970 |
131307683 |
1 |
BrClSF2H6C10 |
ABCD2E6F10 |
-77.91 |
0.96 |
-9.19 |
-1.4 |
0 |
|
|
372971 |
131307719 |
1 |
ClNOI2F3H3C7 |
ABCD2E3F3G7 |
-137.94 |
2.52 |
-10.17 |
-1.96 |
0 |
|
|
372972 |
131307729 |
1 |
SN2O3C9H10 |
AB2C3D9E10 |
-82.52 |
4.78 |
-9.13 |
-0.9 |
0 |
|
|
372973 |
131307742 |
1 |
ClO2N3C10H10 |
AB2C3D10E10 |
-33.29 |
3.49 |
-10.2 |
-1.55 |
0 |
|
|
372974 |
131307756 |
1 |
NOC10H11 |
ABC10D11 |
-17.77 |
1.16 |
-8.1 |
0.23 |
0 |
|
|
372975 |
131307782 |
1 |
NF2O3H7C10 |
AB2C3D7E10 |
-155.95 |
4.49 |
-9.59 |
-1.05 |
0 |
|
|
372976 |
131307883 |
1 |
SN3C9H15 |
AB3C9D15 |
29.87 |
0.84 |
-7.82 |
0.06 |
0 |
|
|
372977 |
131307884 |
1 |
INOC10H12 |
ABCD10E12 |
10.16 |
4.19 |
-8.44 |
-0.39 |
0 |
|
|
372978 |
131307957 |
1 |
NSO4H7C9 |
ABC4D7E9 |
-55.44 |
6.85 |
-9.32 |
-1.45 |
0 |
|
|
372979 |
131307977 |
1 |
ClNO2C10H10 |
ABC2D10E10 |
-41.38 |
1.75 |
-9.81 |
-0.61 |
0 |
|
|
372980 |
131307980 |
1 |
ClNO2C10H10 |
ABC2D10E10 |
-41.26 |
3.12 |
-9.76 |
-0.61 |
0 |
|
|
372981 |
131307981 |
1 |
ClNO2C10H10 |
ABC2D10E10 |
-41.82 |
3.98 |
-9.81 |
-0.59 |
0 |
|
|
372982 |
131307986 |
1 |
BrNOC12H16 |
ABCD12E16 |
-43.28 |
2.74 |
-9.47 |
-0.2 |
0 |
|
|
372983 |
131307995 |
1 |
N2O3C10H10 |
A2B3C10D10 |
-79.39 |
5.68 |
-9.17 |
-0.78 |
0 |
|
|
372984 |
131308046 |
1 |
BrSN2O2H5C10 |
ABC2D2E5F10 |
68.21 |
5.29 |
-9.57 |
-1.67 |
0 |
|
|
372985 |
131308068 |
1 |
N3C11H13 |
A3B11C13 |
44.29 |
3.31 |
-9.64 |
-0.93 |
0 |
|
|
372986 |
131308109 |
1 |
N2S2C11H14 |
A2B2C11D14 |
52.92 |
3.85 |
-8.85 |
-0.78 |
0 |
|
|
372987 |
131308116 |
1 |
BrN4H5C6 |
AB4C5D6 |
87.51 |
2.87 |
-9.96 |
-1.68 |
0 |
|
|
372988 |
131308119 |
1 |
NOSF2H5C9 |
ABCD2E5F9 |
-55.74 |
4.72 |
-9.3 |
-1.96 |
0 |
|
|
372989 |
131308142 |
1 |
IN2O3H5C9 |
AB2C3D5E9 |
39.6 |
3.16 |
-10.45 |
-2.1 |
0 |
|
|
372990 |
131308161 |
1 |
ClNO3H6C9 |
ABC3D6E9 |
-60.78 |
2.37 |
-10.08 |
-1.53 |
0 |
|
|
372991 |
131308184 |
1 |
SO3C12H12 |
AB3C12D12 |
-96.43 |
4.32 |
-8.94 |
-0.9 |
0 |
|
|
372992 |
131308238 |
1 |
O2N4C9H10 |
A2B4C9D10 |
44.93 |
2.23 |
-10.49 |
-1.86 |
0 |
|
|
372993 |
131308342 |
1 |
BrClOC10H12 |
ABCD10E12 |
-52.35 |
3.64 |
-9.32 |
-0.31 |
0 |
|
|
372994 |
131308389 |
1 |
NOCl2H9C11 |
ABC2D9E11 |
-24.42 |
3.53 |
-8.76 |
-0.73 |
0 |
|
|
372995 |
131308390 |
1 |
SN2C8H8 |
AB2C8D8 |
56.92 |
3.41 |
-8.41 |
-0.34 |
0 |
|
|
372996 |
131308400 |
1 |
ClN2O3C9H9 |
AB2C3D9E9 |
-33.88 |
2.95 |
-9.64 |
-1.7 |
0 |
|
|
372997 |
131308417 |
1 |
OSN2C11H14 |
ABC2D11E14 |
-7.7 |
2.38 |
-8.56 |
-0.46 |
0 |
|
|
372998 |
131308422 |
1 |
INO2F3H7C9 |
ABC2D3E7F9 |
-200.42 |
4.28 |
-9.79 |
-1.53 |
0 |
|
|
372999 |
131308444 |
1 |
SN3O3H7C9 |
AB3C3D7E9 |
3.96 |
4.12 |
-9.21 |
-1.36 |
0 |
|
|
373000 |
131308455 |
1 |
INO2C10H12 |
ABC2D10E12 |
-42.26 |
5.15 |
-8.44 |
-0.73 |
0 |
|
|
373001 |
131308466 |
1 |
NSO3C11H11 |
ABC3D11E11 |
-83.15 |
6.28 |
-8.97 |
-1.02 |
0 |
|
|
373002 |
131308475 |
1 |
NO2C12H17 |
AB2C12D17 |
-86.24 |
1.37 |
-9.3 |
0.02 |
0 |
|
|
373003 |
131308476 |
1 |
FNO2C11H14 |
ABC2D11E14 |
-114.92 |
4.83 |
-9.01 |
-0.34 |
0 |
|
|
373004 |
131308492 |
1 |
BrSO3H7C10 |
ABC3D7E10 |
-83.37 |
4.19 |
-8.78 |
-1.09 |
0 |
|
|
373005 |
131308512 |
1 |
ISO3H5C10 |
ABC3D5E10 |
-52.32 |
7.25 |
-9.5 |
-2.13 |
0 |
|
|
373006 |
131308530 |
1 |
ON2C12H12 |
AB2C12D12 |
29.05 |
3.67 |
-9.24 |
-0.51 |
0 |
|
|
373007 |
131308546 |
1 |
ON2C12H12 |
AB2C12D12 |
24.79 |
6.14 |
-8.6 |
-0.81 |
0 |
|
|
373008 |
131308560 |
1 |
ON3C7H9 |
AB3C7D9 |
34.74 |
6.2 |
-9.5 |
-0.02 |
0 |
|
|
373009 |
131308564 |
1 |
ON3C7H9 |
AB3C7D9 |
26.58 |
8.43 |
-9.41 |
-0.2 |
0 |
|
|
373010 |
131308570 |
1 |
BrN3C12H16 |
AB3C12D16 |
49.42 |
3.37 |
-8.99 |
-0.52 |
0 |
|
|
373011 |
131308571 |
1 |
ON3C12H19 |
AB3C12D19 |
-11.38 |
2.35 |
-8.71 |
-0.02 |
0 |
|
|
373012 |
131308574 |
1 |
INOC12H16 |
ABCD12E16 |
-7.58 |
1.86 |
-8.71 |
-0.92 |
0 |
|
|
373013 |
131308579 |
1 |
ON2C13H20 |
AB2C13D20 |
-30.39 |
3.47 |
-8.45 |
0.28 |
0 |
|
|
373014 |
131308582 |
1 |
BrOC8H9 |
ABC8D9 |
-12.31 |
3.93 |
-9.24 |
-0.28 |
0 |
|
|
373015 |
131308584 |
1 |
FNO5H8C9 |
ABC5D8E9 |
-161.26 |
4.87 |
-10.54 |
-1.97 |
0 |
|
|
373016 |
131308640 |
1 |
ClNOSC11H12 |
ABCDE11F12 |
-24.02 |
3.78 |
-8.02 |
-0.72 |
0 |
|
|
373017 |
131308643 |
1 |
ClNOSC11H12 |
ABCDE11F12 |
-26.52 |
4.93 |
-7.97 |
-0.53 |
0 |
|
|
373018 |
131308690 |
1 |
FIO2H8C9 |
ABC2D8E9 |
-80.99 |
2.33 |
-9.32 |
-1.38 |
0 |
|
|
373019 |
131308693 |
1 |
FIO2H8C9 |
ABC2D8E9 |
-84.75 |
4.29 |
-9.42 |
-1.32 |
0 |
|
|
373020 |
131308729 |
1 |
ON2C13H18 |
AB2C13D18 |
-15.83 |
1.76 |
-8.11 |
0.23 |
0 |
|
|
373021 |
131308730 |
1 |
ON2C13H18 |
AB2C13D18 |
-17.48 |
1.86 |
-8.13 |
0.23 |
0 |
|
|
373022 |
131308743 |
1 |
SO3C11H14 |
AB3C11D14 |
-121.1 |
3.79 |
-9.02 |
-0.38 |
0 |
|
|
373023 |
131308747 |
1 |
BrNH2O2F4C7 |
ABC2D2E4F7 |
-235.91 |
0.82 |
-10.56 |
-2.1 |
0 |
|
|
373024 |
131308750 |
1 |
BrNH2O2F4C7 |
ABC2D2E4F7 |
-226.23 |
2.29 |
-10.5 |
-1.82 |
0 |
|
|
373025 |
131308755 |
1 |
ClN2O2F3H6C7 |
AB2C2D3E6F7 |
-221.46 |
5.8 |
-9.23 |
-0.64 |
0 |
|
|
373026 |
131308757 |
1 |
ClN2O2F3H6C7 |
AB2C2D3E6F7 |
-224.12 |
6.71 |
-8.94 |
-0.39 |
0 |
|
|
373027 |
131308760 |
1 |
ClN2O2F3H6C7 |
AB2C2D3E6F7 |
-216.7 |
5.8 |
-8.84 |
-0.86 |
0 |
|
|
373028 |
131308765 |
1 |
ClN2O2F3H6C7 |
AB2C2D3E6F7 |
-211.05 |
8.12 |
-8.9 |
-0.75 |
0 |
|
|
373029 |
131308794 |
1 |
NO3C7H11 |
AB3C7D11 |
-70.41 |
5.61 |
-10.47 |
-0.63 |
0 |
|
|
373030 |
131308813 |
1 |
FNO2C12H14 |
ABC2D12E14 |
-88.08 |
4.21 |
-8.68 |
-0.32 |
0 |
|
|
373031 |
131308816 |
1 |
SN2C13H16 |
AB2C13D16 |
39.32 |
3.76 |
-8.91 |
-0.43 |
0 |
|
|
373032 |
131308819 |
1 |
SN2C13H16 |
AB2C13D16 |
41.23 |
3.42 |
-8.77 |
-0.39 |
0 |
|
|
373033 |
131308825 |
1 |
BrN2O3C10H11 |
AB2C3D10E11 |
-86.2 |
3.05 |
-9.79 |
-1.22 |
0 |
|
|
373034 |
131308846 |
1 |
NOC10H19 |
ABC10D19 |
-53.3 |
4.09 |
-8.7 |
1.13 |
0 |
|
|
373035 |
131308875 |
1 |
NO2F3H8C9 |
AB2C3D8E9 |
-229.92 |
2.19 |
-8.92 |
-0.94 |
0 |
|
|
373036 |
131308885 |
1 |
NO2F3H8C9 |
AB2C3D8E9 |
-227.38 |
5.97 |
-9.31 |
-0.56 |
0 |
|
|
373037 |
131308916 |
1 |
FNO2H6C7 |
ABC2D6E7 |
-83.45 |
3.3 |
-10.44 |
-1.19 |
0 |
|
|
373038 |
131308917 |
1 |
ON2C10H14 |
AB2C10D14 |
-5.12 |
4.42 |
-8.82 |
-0.39 |
0 |
|
|
373039 |
131308950 |
1 |
ON3C12H15 |
AB3C12D15 |
17.79 |
7.76 |
-7.8 |
-0.7 |
0 |
|
|
373040 |
131308963 |
1 |
NO2C12H13 |
AB2C12D13 |
-38.34 |
5.4 |
-9.88 |
-1.03 |
0 |
|
|
373041 |
131308964 |
1 |
NO2C12H13 |
AB2C12D13 |
-43.74 |
5.77 |
-9.42 |
-0.7 |
0 |