List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
197895 |
79012462 |
2 |
NO2C6H8 |
AB2C6D8 |
-166.87 |
6.61 |
-9.1 |
-1.17 |
0 |
|
|
197896 |
79012584 |
1 |
ON2C14H26 |
AB2C14D26 |
-85.4 |
4.11 |
-9.2 |
0.97 |
0 |
|
|
197897 |
79012585 |
2 |
NOC5H10 |
ABC5D10 |
-115.66 |
3.29 |
-9.46 |
0.96 |
0 |
|
|
197898 |
79012729 |
1 |
ON3C14H29 |
AB3C14D29 |
-99.22 |
3.67 |
-8.96 |
1.1 |
0 |
|
|
197899 |
79012864 |
1 |
OF3N3C12H22 |
AB3C3D12E22 |
-231.4 |
6.64 |
-9.48 |
0.76 |
0 |
|
|
197900 |
79012865 |
1 |
O2N3C12H25 |
A2B3C12D25 |
-125.24 |
6.45 |
-9.47 |
0.94 |
0 |
|
|
197901 |
79013097 |
1 |
ON6C8H16 |
AB6C8D16 |
11.02 |
5.12 |
-9.63 |
-0.7 |
0 |
|
|
197902 |
79013128 |
1 |
ON5C14H19 |
AB5C14D19 |
7.01 |
1.68 |
-8.8 |
-0.31 |
0 |
|
|
197903 |
79013129 |
1 |
SN3O3C12H19 |
AB3C3D12E19 |
-116.68 |
5.36 |
-9.44 |
-0.72 |
0 |
|
|
197904 |
79014392 |
2 |
OC6H8 |
AB6C8 |
-87.42 |
0.35 |
-8.67 |
0.11 |
0 |
|
|
197905 |
79014393 |
2 |
FOC5H5 |
ABC5D5 |
-159.02 |
3.83 |
-9.8 |
-0.56 |
0 |
|
|
197906 |
79014394 |
1 |
ClO2C11H13 |
AB2C11D13 |
-86.24 |
4.18 |
-9.21 |
-0.2 |
0 |
|
|
197907 |
79014698 |
1 |
SO2N3C14H25 |
AB2C3D14E25 |
-56.56 |
8.82 |
-9.13 |
0.25 |
0 |
|
|
197908 |
79014699 |
1 |
N2O2S2C15H26 |
A2B2C2D15E26 |
-53.51 |
5.51 |
-9.21 |
-0.88 |
0 |
|
|
197909 |
79014700 |
1 |
SO2N4C14H26 |
AB2C4D14E26 |
-40.18 |
6.22 |
-9.24 |
0.0 |
0 |
|
|
197910 |
79014976 |
1 |
NSO2C11H13 |
ABC2D11E13 |
-45.64 |
4.95 |
-9.34 |
-0.92 |
0 |
|
|
197911 |
79014977 |
1 |
SN2O3C11H16 |
AB2C3D11E16 |
-108.21 |
4.92 |
-9.62 |
-0.21 |
0 |
|
|
197912 |
79014978 |
1 |
SN2O3C9H18 |
AB2C3D9E18 |
-145.27 |
3.79 |
-9.65 |
0.31 |
0 |
|
|
197913 |
79015619 |
1 |
NC18H23 |
AB18C23 |
19.47 |
2.64 |
-9.11 |
0.35 |
0 |
|
|
197914 |
79015620 |
1 |
FO2H15C16 |
AB2C15D16 |
-101.92 |
4.18 |
-9.62 |
-0.24 |
0 |
|
|
197915 |
79015769 |
1 |
BrNC8H16 |
ABC8D16 |
-25.32 |
2.55 |
-8.83 |
-0.08 |
0 |
|
|
197916 |
79015951 |
1 |
FNOC12H16 |
ABCD12E16 |
-75.11 |
2.5 |
-8.8 |
-0.02 |
0 |
|
|
197917 |
79016049 |
1 |
NF3C12H14 |
AB3C12D14 |
-129.57 |
4.01 |
-9.69 |
-0.64 |
0 |
|
|
197918 |
79016236 |
1 |
FNOCl2C12H14 |
ABCD2E12F14 |
-100.35 |
3.67 |
-9.58 |
-0.1 |
0 |
|
|
197919 |
79016248 |
1 |
NF2O2C10H11 |
AB2C2D10E11 |
-171.4 |
1.31 |
-10.1 |
-0.65 |
0 |
|
|
197920 |
79016249 |
1 |
ClON2C11H15 |
ABC2D11E15 |
-39.58 |
2.18 |
-8.2 |
-0.17 |
0 |
|
|
197921 |
79016294 |
1 |
O2N3C15H25 |
A2B3C15D25 |
-50.16 |
2.41 |
-7.67 |
0.4 |
0 |
|
|
197922 |
79016778 |
1 |
ClNOH14C15 |
ABCD14E15 |
-5.67 |
4.68 |
-8.56 |
-0.08 |
0 |
|
|
197923 |
79016827 |
1 |
ClOSN2C14H17 |
ABCD2E14F17 |
-14.74 |
3.03 |
-8.14 |
-0.48 |
0 |
|
|
197924 |
79016860 |
1 |
OSN2F3H3C8 |
ABC2D3E3F8 |
-93.75 |
4.48 |
-9.2 |
-1.78 |
0 |
|
|
197925 |
79017391 |
1 |
SN2C15H20 |
AB2C15D20 |
31.74 |
0.81 |
-9.0 |
-0.22 |
0 |
|
|
197926 |
79017423 |
1 |
ClFNO3C13H13 |
ABCD3E13F13 |
-169.75 |
2.27 |
-9.88 |
-0.74 |
0 |
|
|
197927 |
79017575 |
1 |
ClSN2C14H17 |
ABC2D14E17 |
26.48 |
2.73 |
-9.07 |
-0.28 |
0 |
|
|
197928 |
79017713 |
1 |
NF2C12H17 |
AB2C12D17 |
-90.9 |
4.72 |
-9.07 |
-0.05 |
0 |
|
|
197929 |
79017714 |
1 |
O2H12C13 |
A2B12C13 |
-49.21 |
3.72 |
-8.85 |
-0.76 |
0 |
|
|
197930 |
79017715 |
1 |
NC14H21 |
AB14C21 |
-0.51 |
2.23 |
-8.77 |
0.62 |
0 |
|
|
197931 |
79017716 |
1 |
ClNOSC8H12 |
ABCDE8F12 |
-28.51 |
2.29 |
-9.18 |
-0.74 |
0 |
|
|
197932 |
79017717 |
1 |
ClNOSC8H12 |
ABCDE8F12 |
-24.94 |
3.76 |
-9.09 |
-0.33 |
0 |
|
|
197933 |
79017718 |
1 |
NO2C12H17 |
AB2C12D17 |
-76.44 |
1.58 |
-9.1 |
0.38 |
0 |
|
|
197934 |
79018099 |
1 |
BrFNOH7C12 |
ABCDE7F12 |
-15.12 |
1.6 |
-10.04 |
-1.23 |
0 |
|
|
197935 |
79018447 |
1 |
BrNOC10H12 |
ABCD10E12 |
-19.31 |
2.91 |
-8.46 |
-0.31 |
0 |
|
|
197936 |
79018468 |
1 |
BrO2C10H13 |
AB2C10D13 |
-75.44 |
2.81 |
-9.15 |
-0.26 |
0 |
|
|
197937 |
79018469 |
1 |
ClFNO2H9C11 |
ABCD2E9F11 |
-51.01 |
4.64 |
-9.12 |
-0.97 |
0 |
|
|
197938 |
79018470 |
1 |
BrFNOC9H9 |
ABCDE9F9 |
-49.35 |
3.66 |
-9.79 |
-0.72 |
0 |
|
|
197939 |
79018553 |
1 |
ClFNOC11H15 |
ABCDE11F15 |
-87.55 |
4.41 |
-8.84 |
-0.34 |
0 |
|
|
197940 |
79018598 |
1 |
ClNOC11H16 |
ABCD11E16 |
-41.09 |
3.22 |
-8.83 |
-0.1 |
0 |
|
|
197941 |
79018599 |
1 |
ClNOC11H16 |
ABCD11E16 |
-37.75 |
0.61 |
-9.03 |
-0.13 |
0 |
|
|
197942 |
79018600 |
1 |
NC15H23 |
AB15C23 |
-14.72 |
2.05 |
-9.07 |
0.39 |
0 |
|
|
197943 |
79018835 |
1 |
BrON3C13H14 |
ABC3D13E14 |
6.86 |
8.78 |
-8.51 |
-0.49 |
0 |
|
|
197944 |
79019547 |
1 |
O4C13H18 |
A4B13C18 |
-162.21 |
5.0 |
-8.71 |
-0.36 |
0 |