List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
36953 |
8015295 |
1 |
NO5C20H21 |
AB5C20D21 |
-163.62 |
4.73 |
-8.85 |
-0.76 |
0 |
|
|
36954 |
8015316 |
1 |
NO5C18H19 |
AB5C18D19 |
-157.11 |
3.67 |
-8.87 |
-0.15 |
0 |
|
|
36955 |
8015342 |
1 |
Cl2N2O4C11H12 |
A2B2C4D11E12 |
-153.52 |
2.63 |
-9.13 |
-0.82 |
0 |
|
|
36956 |
8015345 |
1 |
NO4H17C19 |
AB4C17D19 |
-88.43 |
4.58 |
-8.99 |
-0.62 |
0 |
|
|
36957 |
8015355 |
1 |
NSO6C21H23 |
ABC6D21E23 |
-210.96 |
5.42 |
-8.54 |
-0.72 |
0 |
|
|
36958 |
8015360 |
1 |
NCl2O4C13H15 |
AB2C4D13E15 |
-167.61 |
3.3 |
-9.64 |
-0.6 |
1 |
|
|
36959 |
8015383 |
1 |
N2O3C24H29 |
A2B3C24D29 |
-60.43 |
9.37 |
0.0 |
0.0 |
0 |
|
|
36960 |
8015384 |
1 |
N2O3C24H28 |
A2B3C24D28 |
-73.46 |
7.76 |
-8.52 |
-0.87 |
1 |
|
|
36961 |
8015385 |
1 |
N2O4C23H27 |
A2B4C23D27 |
-85.85 |
8.96 |
0.0 |
0.0 |
0 |
|
|
36962 |
8015403 |
1 |
SN3O3C19H19 |
AB3C3D19E19 |
-45.75 |
7.48 |
-8.73 |
-0.96 |
0 |
|
|
36963 |
8015404 |
1 |
N2O5C20H20 |
A2B5C20D20 |
-79.5 |
3.13 |
-9.3 |
-1.11 |
1 |
|
|
36964 |
8015444 |
1 |
FOCl2N3C19H21 |
ABC2D3E19F21 |
-39.92 |
4.22 |
0.0 |
0.0 |
0 |
|
|
36965 |
8015447 |
1 |
ClO2N3C20H24 |
AB2C3D20E24 |
-41.01 |
5.63 |
-8.3 |
-0.27 |
0 |
|
|
36966 |
8015468 |
1 |
O2N3C23H25 |
A2B3C23D25 |
-20.9 |
2.99 |
-8.48 |
-0.4 |
0 |
|
|
36967 |
8015477 |
1 |
ON2H20C21 |
AB2C20D21 |
18.27 |
3.74 |
-8.19 |
-0.26 |
1 |
|
|
36968 |
8015481 |
1 |
FOCl2N3C19H21 |
ABC2D3E19F21 |
-42.86 |
3.69 |
0.0 |
0.0 |
0 |
|
|
36969 |
8015482 |
1 |
FOCl2N3C19H20 |
ABC2D3E19F20 |
-58.8 |
3.49 |
-8.52 |
-0.63 |
1 |
|
|
36970 |
8015487 |
1 |
BrFON3C19H22 |
ABCD3E19F22 |
-21.61 |
8.08 |
0.0 |
0.0 |
0 |
|
|
36971 |
8015499 |
1 |
FN2O4C20H21 |
AB2C4D20E21 |
-159.13 |
4.33 |
-8.43 |
-1.42 |
0 |
|
|
36972 |
8015510 |
1 |
N2O3C22H22 |
A2B3C22D22 |
-64.41 |
7.09 |
-8.49 |
-0.77 |
0 |
|
|
36973 |
8015554 |
1 |
NSF2O4C17H21 |
ABC2D4E17F21 |
-251.98 |
5.0 |
-9.03 |
-0.32 |
0 |
|
|
36974 |
8015571 |
1 |
SN3O5C20H25 |
AB3C5D20E25 |
-185.1 |
3.89 |
-8.76 |
-0.71 |
0 |
|
|
36975 |
8015575 |
1 |
NSF2O3H9C12 |
ABC2D3E9F12 |
-165.53 |
3.23 |
-9.36 |
-1.19 |
0 |
|
|
36976 |
8015576 |
1 |
ClFNSO4C18H21 |
ABCDE4F18G21 |
-178.65 |
4.93 |
-8.24 |
-1.35 |
-1 |
|
|
36977 |
8015578 |
1 |
NSO6H14C15 |
ABC6D14E15 |
-125.87 |
20.36 |
0.0 |
0.0 |
0 |
|
|
36978 |
8015605 |
1 |
SN3O5C20H23 |
AB3C5D20E23 |
-147.33 |
5.39 |
-9.11 |
-1.13 |
0 |
|
|
36979 |
8015624 |
1 |
SN2O6H18C20 |
AB2C6D18E20 |
-156.12 |
3.17 |
-8.94 |
-1.26 |
0 |
|
|
36980 |
8015640 |
1 |
SN2O4H18C21 |
AB2C4D18E21 |
-85.65 |
2.77 |
-8.87 |
-0.82 |
0 |
|
|
36981 |
8015660 |
1 |
SF2N2O3H18C21 |
AB2C2D3E18F21 |
-149.38 |
2.57 |
-8.62 |
-1.46 |
1 |
|
|
36982 |
8015729 |
1 |
NO5C23H36 |
AB5C23D36 |
-210.0 |
3.26 |
0.0 |
0.0 |
1 |
|
|
36983 |
8015733 |
1 |
N2O4C25H33 |
A2B4C25D33 |
-152.34 |
17.67 |
0.0 |
0.0 |
1 |
|
|
36984 |
8015779 |
1 |
N2O5C22H27 |
A2B5C22D27 |
-158.0 |
11.08 |
0.0 |
0.0 |
0 |
|
|
36985 |
8015783 |
1 |
NO4C21H33 |
AB4C21D33 |
-185.01 |
1.8 |
-9.15 |
0.71 |
0 |
|
|
36986 |
8015785 |
1 |
NO4C21H33 |
AB4C21D33 |
-185.1 |
1.28 |
-9.18 |
0.7 |
0 |
|
|
36987 |
8015787 |
1 |
NO4C21H33 |
AB4C21D33 |
-181.82 |
3.28 |
-8.97 |
0.7 |
1 |
|
|
36988 |
8015793 |
1 |
N2O4C23H27 |
A2B4C23D27 |
-88.04 |
8.13 |
0.0 |
0.0 |
-1 |
|
|
36989 |
8015812 |
1 |
N3O4H20C23 |
A3B4C20D23 |
-76.24 |
7.69 |
0.0 |
0.0 |
0 |
|
|
36990 |
8015817 |
1 |
N3O5H17C19 |
A3B5C17D19 |
-167.24 |
4.55 |
-9.2 |
-1.01 |
0 |
|
|
36991 |
8015820 |
1 |
NO8C17H23 |
AB8C17D23 |
-325.34 |
3.0 |
-9.24 |
-0.88 |
0 |
|
|
36992 |
8015829 |
1 |
SN2O2H18C22 |
AB2C2D18E22 |
10.08 |
3.47 |
-8.55 |
-0.23 |
0 |
|
|
36993 |
8015875 |
1 |
NO4H23C24 |
AB4C23D24 |
-114.34 |
4.06 |
-9.22 |
-1.3 |
-1 |
|
|
36994 |
8016002 |
1 |
NO6C21H24 |
AB6C21D24 |
-251.58 |
7.67 |
0.0 |
0.0 |
0 |
|
|
36995 |
8016023 |
1 |
NO4H21C23 |
AB4C21D23 |
-103.79 |
6.17 |
-8.84 |
-1.21 |
-1 |
|
|
36996 |
8016024 |
1 |
O4N5C21H28 |
A4B5C21D28 |
-127.23 |
6.4 |
0.0 |
0.0 |
0 |
|
|
36997 |
8016027 |
1 |
O3N4C23H24 |
A3B4C23D24 |
-52.82 |
4.44 |
-8.09 |
-0.23 |
0 |
|
|
36998 |
8016031 |
1 |
NO4C26H29 |
AB4C26D29 |
-126.53 |
6.37 |
-9.06 |
-0.87 |
0 |
|
|
36999 |
8016033 |
1 |
NO6C21H23 |
AB6C21D23 |
-226.12 |
9.44 |
-9.39 |
-1.15 |
0 |
|
|
37000 |
8016036 |
1 |
NO6C21H21 |
AB6C21D21 |
-217.87 |
6.27 |
-9.38 |
-0.78 |
0 |
|
|
37001 |
8016046 |
1 |
N2O4C23H24 |
A2B4C23D24 |
-106.66 |
7.53 |
-9.11 |
-0.99 |
1 |
|
|
37002 |
8016049 |
1 |
O3N4C19H27 |
A3B4C19D27 |
-55.95 |
7.13 |
0.0 |
0.0 |
0 |
|
|
37003 |
8016053 |
1 |
O5H14C19 |
A5B14C19 |
-108.03 |
9.01 |
-8.6 |
-1.25 |
0 |
|
|
37004 |
8016056 |
1 |
NO6C21H23 |
AB6C21D23 |
-240.88 |
12.33 |
-9.37 |
-1.33 |
0 |
|
|
37005 |
8016058 |
1 |
NO6C21H23 |
AB6C21D23 |
-243.2 |
6.38 |
-9.15 |
-1.1 |
-1 |
|
|
37006 |
8016063 |
1 |
NO7C22H24 |
AB7C22D24 |
-256.0 |
6.05 |
0.0 |
0.0 |
0 |
|
|
37007 |
8016065 |
1 |
NO6C20H21 |
AB6C20D21 |
-226.87 |
5.68 |
-8.9 |
-0.67 |
0 |
|
|
37008 |
8016067 |
1 |
N2O4C25H28 |
A2B4C25D28 |
-124.48 |
6.18 |
-8.99 |
-0.86 |
1 |
|
|
37009 |
8016072 |
1 |
O2N3C15H22 |
A2B3C15D22 |
-71.69 |
4.58 |
0.0 |
0.0 |
1 |
|
|
37010 |
8016110 |
1 |
N2O4C19H21 |
A2B4C19D21 |
-87.12 |
6.68 |
0.0 |
0.0 |
0 |
|
|
37011 |
8016114 |
1 |
NO4C21H25 |
AB4C21D25 |
-135.68 |
7.32 |
-8.96 |
-0.86 |
0 |
|
|
37012 |
8016123 |
1 |
NO4H23C24 |
AB4C23D24 |
-103.8 |
7.33 |
-8.99 |
-1.19 |
0 |
|
|
37013 |
8016136 |
1 |
N2O3C18H20 |
A2B3C18D20 |
-63.28 |
4.23 |
-8.21 |
-0.56 |
0 |
|
|
37014 |
8016138 |
1 |
NSO4H19C21 |
ABC4D19E21 |
-102.33 |
5.52 |
-8.8 |
-1.27 |
0 |
|
|
37015 |
8016143 |
1 |
NO5C19H23 |
AB5C19D23 |
-189.83 |
6.18 |
-9.31 |
-1.1 |
-1 |
|
|
37016 |
8016144 |
1 |
O2N6H13C16 |
A2B6C13D16 |
84.75 |
20.82 |
0.0 |
0.0 |
-1 |
|
|
37017 |
8016185 |
1 |
ClNO6C20H21 |
ABC6D20E21 |
-231.13 |
5.88 |
0.0 |
0.0 |
0 |
|
|
37018 |
8016186 |
1 |
ClNO6C20H22 |
ABC6D20E22 |
-239.01 |
10.11 |
-9.66 |
-1.63 |
0 |
|
|
37019 |
8016188 |
1 |
NO5C22H29 |
AB5C22D29 |
-208.95 |
5.03 |
-8.93 |
-0.8 |
-1 |
|
|
37020 |
8016193 |
1 |
NO6C23H26 |
AB6C23D26 |
-241.43 |
7.06 |
0.0 |
0.0 |
0 |
|
|
37021 |
8016210 |
2 |
O3H5C7 |
A3B5C7 |
-174.63 |
5.2 |
-9.76 |
-1.19 |
0 |
|
|
37022 |
8016218 |
1 |
N2O5C19H20 |
A2B5C19D20 |
-177.3 |
8.1 |
-9.52 |
-0.66 |
-1 |
|
|
37023 |
8016228 |
1 |
NO6C21H22 |
AB6C21D22 |
-225.17 |
6.88 |
0.0 |
0.0 |
-1 |
|
|
37024 |
8016233 |
1 |
O4N5H20C21 |
A4B5C20D21 |
-64.81 |
5.98 |
0.0 |
0.0 |
1 |
|
|
37025 |
8016235 |
1 |
O2N3C21H22 |
A2B3C21D22 |
-12.37 |
8.0 |
0.0 |
0.0 |
0 |
|
|
37026 |
8016266 |
1 |
NO6C21H23 |
AB6C21D23 |
-243.78 |
12.88 |
-9.14 |
-1.28 |
0 |
|
|
37027 |
8016274 |
1 |
O2N3H21C22 |
A2B3C21D22 |
-21.46 |
0.86 |
-8.48 |
-0.28 |
-1 |
|
|
37028 |
8016279 |
1 |
NO7C21H22 |
AB7C21D22 |
-220.71 |
7.57 |
0.0 |
0.0 |
-1 |
|
|
37029 |
8016281 |
1 |
O4N5C19H24 |
A4B5C19D24 |
-117.62 |
5.29 |
0.0 |
0.0 |
-1 |
|
|
37030 |
8016284 |
1 |
O4N5C20H26 |
A4B5C20D26 |
-124.73 |
6.38 |
0.0 |
0.0 |
0 |
|
|
37031 |
8016289 |
1 |
NO6C22H25 |
AB6C22D25 |
-245.01 |
5.16 |
-9.22 |
-1.2 |
0 |
|
|
37032 |
8016291 |
1 |
NO6C22H25 |
AB6C22D25 |
-248.26 |
5.63 |
-9.12 |
-1.08 |
0 |
|
|
37033 |
8016293 |
2 |
N2O2C11H11 |
A2B2C11D11 |
-120.14 |
7.56 |
-8.49 |
-1.1 |
0 |
|
|
37034 |
8016294 |
1 |
FNO4C25H26 |
ABC4D25E26 |
-199.35 |
6.98 |
-8.92 |
-0.84 |
0 |
|
|
37035 |
8016304 |
1 |
O2N4H20C21 |
A2B4C20D21 |
-17.95 |
2.24 |
-8.5 |
-0.38 |
0 |
|
|
37036 |
8016314 |
1 |
O2N3H19C20 |
A2B3C19D20 |
-15.77 |
1.53 |
-8.7 |
-0.78 |
0 |
|
|
37037 |
8016319 |
1 |
N2O4C23H24 |
A2B4C23D24 |
-112.06 |
9.97 |
-9.32 |
-0.91 |
0 |
|
|
37038 |
8016321 |
1 |
NO6C20H21 |
AB6C20D21 |
-236.15 |
11.85 |
-9.35 |
-1.32 |
0 |
|
|
37039 |
8016326 |
1 |
NO6C19H19 |
AB6C19D19 |
-234.87 |
12.98 |
-9.14 |
-1.28 |
0 |
|
|
37040 |
8016336 |
1 |
SO5H18C23 |
AB5C18D23 |
-57.49 |
5.95 |
-8.4 |
-1.14 |
-1 |
|
|
37041 |
8016351 |
1 |
O6H19C22 |
A6B19C22 |
-183.65 |
5.12 |
0.0 |
0.0 |
0 |
|
|
37042 |
8016360 |
2 |
NO2H9C11 |
AB2C9D11 |
-62.54 |
1.71 |
-8.14 |
-1.18 |
0 |
|
|
37043 |
8016366 |
3 |
NOH7C8 |
ABC7D8 |
-44.42 |
4.04 |
-8.74 |
-1.55 |
0 |
|
|
37044 |
8016381 |
1 |
ClON2H13C24 |
ABC2D13E24 |
68.58 |
0.67 |
-8.93 |
-1.49 |
0 |
|
|
37045 |
8016394 |
1 |
N2O4H16C21 |
A2B4C16D21 |
-59.4 |
3.66 |
-8.4 |
-1.15 |
0 |
|
|
37046 |
8016395 |
2 |
NO2H7C10 |
AB2C7D10 |
-59.69 |
3.6 |
-8.31 |
-1.31 |
1 |
|
|
37047 |
8016396 |
1 |
ON2C22H31 |
AB2C22D31 |
-10.55 |
3.73 |
0.0 |
0.0 |
0 |
|
|
37048 |
8016410 |
1 |
N2O5C21H24 |
A2B5C21D24 |
-165.01 |
7.44 |
-8.58 |
-0.15 |
0 |
|
|
37049 |
8016412 |
1 |
N2O5H20C24 |
A2B5C20D24 |
-102.17 |
5.13 |
-8.3 |
-1.32 |
0 |
|
|
37050 |
8016414 |
1 |
N3O3H19C24 |
A3B3C19D24 |
-37.25 |
3.29 |
-8.98 |
-1.48 |
0 |
|
|
37051 |
8016419 |
1 |
ON2C22H30 |
AB2C22D30 |
-19.36 |
3.56 |
-8.54 |
-0.02 |
-1 |
|
|
37052 |
8016423 |
1 |
NO6C22H24 |
AB6C22D24 |
-239.17 |
7.08 |
0.0 |
0.0 |
0 |