List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
199895 |
79315090 |
1 |
O2N3C13H27 |
A2B3C13D27 |
-103.84 |
2.07 |
-8.58 |
0.65 |
0 |
|
|
199896 |
79315197 |
1 |
SN2C16H24 |
AB2C16D24 |
12.55 |
2.79 |
-8.32 |
0.19 |
0 |
|
|
199897 |
79315334 |
1 |
SN2O2C15H18 |
AB2C2D15E18 |
-69.63 |
1.71 |
-8.52 |
-0.31 |
0 |
|
|
199898 |
79315430 |
1 |
O2N3C15H31 |
A2B3C15D31 |
-107.26 |
2.16 |
-8.59 |
0.73 |
0 |
|
|
199899 |
79315431 |
1 |
O2N3C15H31 |
A2B3C15D31 |
-113.81 |
1.91 |
-8.54 |
0.69 |
0 |
|
|
199900 |
79315574 |
1 |
O2N3C11H23 |
A2B3C11D23 |
-91.72 |
2.04 |
-8.58 |
0.78 |
0 |
|
|
199901 |
79315737 |
1 |
SN3O3C13H23 |
AB3C3D13E23 |
-137.12 |
4.96 |
-8.85 |
-0.4 |
0 |
|
|
199902 |
79315912 |
1 |
N3C17H25 |
A3B17C25 |
68.18 |
2.31 |
-8.73 |
-0.14 |
0 |
|
|
199903 |
79316539 |
1 |
O2N5C11H17 |
A2B5C11D17 |
-16.94 |
3.51 |
-9.52 |
-0.57 |
0 |
|
|
199904 |
79316540 |
1 |
ON5C12H21 |
AB5C12D21 |
6.25 |
0.71 |
-9.68 |
-0.42 |
0 |
|
|
199905 |
79316541 |
1 |
O2N5C13H21 |
A2B5C13D21 |
-15.29 |
4.87 |
-9.28 |
-0.18 |
0 |
|
|
199906 |
79316542 |
1 |
ON6C13H22 |
AB6C13D22 |
22.86 |
2.54 |
-8.6 |
-0.52 |
0 |
|
|
199907 |
79316562 |
1 |
ON6C10H14 |
AB6C10D14 |
94.26 |
4.97 |
-10.02 |
-1.06 |
0 |
|
|
199908 |
79316563 |
1 |
O2N4C13H22 |
A2B4C13D22 |
-39.58 |
8.3 |
-9.73 |
-0.68 |
0 |
|
|
199909 |
79316711 |
1 |
ON5C12H19 |
AB5C12D19 |
36.15 |
0.73 |
-9.8 |
-0.46 |
0 |
|
|
199910 |
79316712 |
1 |
ON5C13H21 |
AB5C13D21 |
10.54 |
0.7 |
-9.78 |
-0.44 |
0 |
|
|
199911 |
79316713 |
1 |
O3N5C11H19 |
A3B5C11D19 |
-55.2 |
2.64 |
-9.6 |
-0.29 |
0 |
|
|
199912 |
79316825 |
1 |
ON6C11H20 |
AB6C11D20 |
30.07 |
1.04 |
-8.63 |
-0.42 |
0 |
|
|
199913 |
79316868 |
1 |
ON5C14H23 |
AB5C14D23 |
5.28 |
1.01 |
-9.67 |
-0.46 |
0 |
|
|
199914 |
79316934 |
1 |
O2N5C12H15 |
A2B5C12D15 |
21.41 |
1.57 |
-9.04 |
-0.49 |
0 |
|
|
199915 |
79317270 |
1 |
ON3C16H31 |
AB3C16D31 |
-22.11 |
3.14 |
-8.81 |
2.02 |
0 |
|
|
199916 |
79317271 |
1 |
ON3C15H31 |
AB3C15D31 |
-46.9 |
3.47 |
-8.29 |
2.47 |
0 |
|
|
199917 |
79317272 |
1 |
ON3C11H25 |
AB3C11D25 |
-62.27 |
2.75 |
-8.77 |
2.29 |
0 |
|
|
199918 |
79317350 |
1 |
SO2N3C12H25 |
AB2C3D12E25 |
-71.99 |
4.82 |
-8.93 |
0.42 |
0 |
|
|
199919 |
79317376 |
2 |
O2N3C4H6 |
A2B3C4D6 |
-100.51 |
4.68 |
-11.0 |
-1.49 |
0 |
|
|
199920 |
79317377 |
1 |
ClO2N5C10H10 |
AB2C5D10E10 |
22.51 |
3.81 |
-10.23 |
-1.47 |
0 |
|
|
199921 |
79317514 |
1 |
ON3C15H33 |
AB3C15D33 |
-77.18 |
2.07 |
-8.55 |
2.52 |
0 |
|
|
199922 |
79317555 |
1 |
NO3C13H21 |
AB3C13D21 |
-170.36 |
3.92 |
-10.05 |
-0.12 |
0 |
|
|
199923 |
79317701 |
1 |
O4N5C11H13 |
A4B5C11D13 |
-51.91 |
7.04 |
-9.81 |
-1.25 |
0 |
|
|
199924 |
79317702 |
1 |
O3N5C9H15 |
A3B5C9D15 |
-52.45 |
4.49 |
-10.02 |
-1.03 |
0 |
|
|
199925 |
79318050 |
2 |
NOC6H10 |
ABC6D10 |
-112.55 |
4.7 |
-9.13 |
-0.14 |
0 |
|
|
199926 |
79318051 |
2 |
NOC7H12 |
ABC7D12 |
-118.5 |
4.84 |
-8.73 |
-0.07 |
0 |
|
|
199927 |
79318083 |
1 |
O2N4C9H16 |
A2B4C9D16 |
-30.93 |
5.33 |
-11.38 |
-1.15 |
0 |
|
|
199928 |
79318110 |
1 |
NO2F3C12H16 |
AB2C3D12E16 |
-284.99 |
3.52 |
-10.78 |
-0.17 |
0 |
|
|
199929 |
79318238 |
1 |
O3N5C10H13 |
A3B5C10D13 |
-4.05 |
5.67 |
-10.35 |
-1.37 |
0 |
|
|
199930 |
79318247 |
1 |
O4N7C9H11 |
A4B7C9D11 |
-26.9 |
6.65 |
-9.96 |
-1.73 |
0 |
|
|
199931 |
79318248 |
1 |
BrO3N4C12H13 |
AB3C4D12E13 |
-16.55 |
3.85 |
-9.3 |
-1.48 |
0 |
|
|
199932 |
79318354 |
1 |
FNO2C16H20 |
ABC2D16E20 |
-150.68 |
3.22 |
-9.66 |
-0.28 |
0 |
|
|
199933 |
79318944 |
1 |
N3O3C14H27 |
A3B3C14D27 |
-156.32 |
1.64 |
-8.86 |
0.4 |
0 |
|
|
199934 |
79318967 |
1 |
ON2C12H24 |
AB2C12D24 |
-58.45 |
3.27 |
-8.5 |
0.69 |
0 |
|
|
199935 |
79319191 |
1 |
OSN2C15H24 |
ABC2D15E24 |
-30.94 |
2.94 |
-8.7 |
-0.32 |
0 |
|
|
199936 |
79319192 |
2 |
NOC8H12 |
ABC8D12 |
-51.17 |
3.94 |
-8.78 |
-0.45 |
0 |
|
|
199937 |
79319622 |
1 |
ON2C13H26 |
AB2C13D26 |
-63.72 |
1.59 |
-8.34 |
0.68 |
0 |
|
|
199938 |
79319975 |
1 |
ON2C16H26 |
AB2C16D26 |
-42.12 |
3.4 |
-8.35 |
0.36 |
0 |
|
|
199939 |
79320868 |
1 |
NO2C11H17 |
AB2C11D17 |
-99.63 |
4.66 |
-10.57 |
0.02 |
0 |
|
|
199940 |
79321217 |
1 |
NC16H29 |
AB16C29 |
-32.36 |
1.72 |
-8.81 |
2.62 |
0 |
|
|
199941 |
79321346 |
1 |
BrNSO2C11H12 |
ABCD2E11F12 |
-74.78 |
3.23 |
-9.61 |
-0.95 |
0 |
|
|
199942 |
79321652 |
1 |
NC19H29 |
AB19C29 |
-10.56 |
2.12 |
-8.83 |
0.41 |
0 |
|
|
199943 |
79321898 |
1 |
FN2O4H13C14 |
AB2C4D13E14 |
-159.55 |
7.61 |
-8.86 |
-0.87 |
0 |
|
|
199944 |
79321899 |
1 |
SN3O3H11C14 |
AB3C3D11E14 |
-54.01 |
3.94 |
-8.81 |
-0.99 |
0 |