List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
290000 |
104396995 |
2 |
NC8H18 |
AB8C18 |
-72.51 |
1.99 |
-8.58 |
2.96 |
0 |
|
|
290001 |
104397025 |
1 |
N2F4C15H22 |
A2B4C15D22 |
-209.68 |
5.65 |
-8.91 |
-0.65 |
0 |
|
|
290002 |
104397116 |
4 |
NC3H6 |
AB3C6 |
15.63 |
3.97 |
-9.06 |
0.84 |
0 |
|
|
290003 |
104397137 |
1 |
ON2C13H28 |
AB2C13D28 |
-81.51 |
2.5 |
-8.48 |
2.41 |
0 |
|
|
290004 |
104397217 |
2 |
NC9H18 |
AB9C18 |
-61.06 |
0.81 |
-8.83 |
2.71 |
0 |
|
|
290005 |
104397219 |
1 |
ON2C13H28 |
AB2C13D28 |
-80.11 |
4.17 |
-8.98 |
2.54 |
0 |
|
|
290006 |
104397223 |
2 |
NC6H14 |
AB6C14 |
-46.55 |
2.35 |
-8.63 |
2.9 |
0 |
|
|
290007 |
104397305 |
2 |
FNC7H11 |
ABC7D11 |
-97.72 |
3.65 |
-9.1 |
-0.32 |
0 |
|
|
290008 |
104397340 |
1 |
BrClN2C14H22 |
ABC2D14E22 |
-8.11 |
1.99 |
-8.98 |
-0.5 |
0 |
|
|
290009 |
104397399 |
1 |
SN4C10H20 |
AB4C10D20 |
35.5 |
5.66 |
-9.18 |
-0.93 |
0 |
|
|
290010 |
104397403 |
1 |
FN2C15H25 |
AB2C15D25 |
-57.29 |
1.45 |
-8.78 |
0.28 |
0 |
|
|
290011 |
104397405 |
1 |
BrSN2C13H23 |
ABC2D13E23 |
3.03 |
3.63 |
-8.9 |
-0.14 |
0 |
|
|
290012 |
104397445 |
1 |
FON2C15H25 |
ABC2D15E25 |
-83.08 |
2.36 |
-8.77 |
0.08 |
0 |
|
|
290013 |
104397457 |
2 |
NOC8H14 |
ABC8D14 |
-72.93 |
1.37 |
-8.16 |
0.39 |
0 |
|
|
290014 |
104397652 |
1 |
OCl2N2C13H20 |
AB2C2D13E20 |
-48.43 |
2.14 |
-9.01 |
-0.48 |
0 |
|
|
290015 |
104397655 |
1 |
ON2C16H26 |
AB2C16D26 |
-40.15 |
0.54 |
-8.73 |
0.6 |
0 |
|
|
290016 |
104397667 |
1 |
ON2C14H28 |
AB2C14D28 |
-51.04 |
1.68 |
-8.72 |
2.4 |
0 |
|
|
290017 |
104397671 |
1 |
OSN2C15H26 |
ABC2D15E26 |
-36.86 |
1.93 |
-8.8 |
0.13 |
0 |
|
|
290018 |
104397682 |
1 |
ClOSN2C11H19 |
ABCD2E11F19 |
-26.49 |
0.92 |
-8.95 |
-0.51 |
0 |
|
|
290019 |
104397724 |
1 |
ON4C10H20 |
AB4C10D20 |
-20.15 |
3.74 |
-9.16 |
0.6 |
0 |
|
|
290020 |
104397745 |
1 |
ON4C14H22 |
AB4C14D22 |
12.23 |
4.03 |
-8.57 |
-0.28 |
0 |
|
|
290021 |
104397786 |
1 |
OF2N2C14H22 |
AB2C2D14E22 |
-123.85 |
2.69 |
-8.87 |
-0.32 |
0 |
|
|
290022 |
104397817 |
1 |
ClON2C14H23 |
ABC2D14E23 |
-44.0 |
1.56 |
-8.97 |
0.01 |
0 |
|
|
290023 |
104397939 |
1 |
OSN3C14H19 |
ABC3D14E19 |
-11.35 |
4.06 |
-8.75 |
-0.78 |
0 |
|
|
290024 |
104397940 |
1 |
ON4C15H20 |
AB4C15D20 |
-13.82 |
2.46 |
-8.94 |
-0.72 |
0 |
|
|
290025 |
104397966 |
1 |
ON4C13H16 |
AB4C13D16 |
20.06 |
4.26 |
-9.44 |
-0.92 |
0 |
|
|
290026 |
104398036 |
1 |
BrON3C14H18 |
ABC3D14E18 |
-13.96 |
5.89 |
-9.06 |
-0.73 |
0 |
|
|
290027 |
104398545 |
1 |
SN3O3C14H29 |
AB3C3D14E29 |
-170.69 |
4.66 |
-9.14 |
0.14 |
0 |
|
|
290028 |
104398661 |
2 |
NO2C7H9 |
AB2C7D9 |
-137.36 |
1.51 |
-8.81 |
-0.9 |
0 |
|
|
290029 |
104399137 |
2 |
ON2C7H11 |
AB2C7D11 |
-74.87 |
3.14 |
-9.04 |
-0.35 |
0 |
|
|
290030 |
104399494 |
1 |
N4O4C13H16 |
A4B4C13D16 |
-62.62 |
4.25 |
-9.49 |
-1.4 |
0 |
|
|
290031 |
104399717 |
1 |
N4O4C13H20 |
A4B4C13D20 |
-92.74 |
5.09 |
-9.65 |
-1.25 |
0 |
|
|
290032 |
104399785 |
1 |
BrN3O3C13H18 |
AB3C3D13E18 |
-50.6 |
9.78 |
-9.03 |
-1.17 |
0 |
|
|
290033 |
104399839 |
2 |
ON2C6H10 |
AB2C6D10 |
-76.91 |
5.3 |
-8.52 |
-0.54 |
0 |
|
|
290034 |
104399962 |
1 |
O3N4C13H22 |
A3B4C13D22 |
-115.91 |
3.65 |
-9.25 |
-0.09 |
0 |
|
|
290035 |
104400070 |
1 |
O2F3N3C12H16 |
A2B3C3D12E16 |
-228.49 |
1.77 |
-9.34 |
-0.74 |
0 |
|
|
290036 |
104400740 |
1 |
SO2N3C10H19 |
AB2C3D10E19 |
-83.28 |
3.97 |
-9.12 |
-0.3 |
0 |
|
|
290037 |
104400949 |
1 |
ClON4C15H21 |
ABC4D15E21 |
-34.44 |
5.2 |
-9.28 |
-0.86 |
0 |
|
|
290038 |
104401505 |
1 |
N3O4C14H25 |
A3B4C14D25 |
-209.99 |
5.97 |
-10.0 |
0.44 |
0 |
|
|
290039 |
104401576 |
1 |
N3O4C13H23 |
A3B4C13D23 |
-207.72 |
5.61 |
-9.74 |
-0.1 |
0 |
|
|
290040 |
104401657 |
1 |
SN3O5C11H19 |
AB3C5D11E19 |
-218.56 |
6.21 |
-9.33 |
-0.37 |
0 |
|
|
290041 |
104401931 |
1 |
BrON3C11H14 |
ABC3D11E14 |
-10.25 |
2.55 |
-9.1 |
-0.52 |
0 |
|
|
290042 |
104402005 |
1 |
ClO2N5C13H22 |
AB2C5D13E22 |
-79.87 |
2.84 |
-9.72 |
-0.66 |
0 |
|
|
290043 |
104402140 |
1 |
O2N5C11H17 |
A2B5C11D17 |
-35.1 |
6.67 |
-9.38 |
-0.14 |
0 |
|
|
290044 |
104402383 |
1 |
N3O3C15H19 |
A3B3C15D19 |
-97.3 |
6.54 |
-9.05 |
-0.52 |
0 |
|
|
290045 |
104402456 |
1 |
SO2N3C14H19 |
AB2C3D14E19 |
-30.55 |
3.06 |
-9.44 |
-0.87 |
0 |
|
|
290046 |
104402590 |
1 |
O3N4C12H16 |
A3B4C12D16 |
-83.71 |
3.27 |
-9.24 |
-0.95 |
0 |
|
|
290047 |
104402848 |
2 |
ON2C7H11 |
AB2C7D11 |
-87.1 |
2.76 |
-8.67 |
-0.16 |
0 |
|
|
290048 |
104403093 |
1 |
O3N4C12H18 |
A3B4C12D18 |
-104.81 |
6.58 |
-9.43 |
-0.76 |
0 |
|
|
290049 |
104403334 |
1 |
N3O3C14H27 |
A3B3C14D27 |
-165.99 |
5.53 |
-9.53 |
0.93 |
0 |
|
|
290050 |
104403429 |
1 |
O2N3C14H25 |
A2B3C14D25 |
-94.93 |
3.83 |
-9.28 |
0.48 |
0 |
|
|
290051 |
104403912 |
1 |
ON5C12H19 |
AB5C12D19 |
-13.38 |
1.53 |
-9.01 |
0.24 |
0 |
|
|
290052 |
104404084 |
1 |
ON5C15H27 |
AB5C15D27 |
-60.86 |
4.93 |
-8.55 |
0.52 |
0 |
|
|
290053 |
104404237 |
1 |
O2N5C14H25 |
A2B5C14D25 |
-76.15 |
5.67 |
-8.95 |
-0.05 |
0 |
|
|
290054 |
104404667 |
1 |
O2N5C14H23 |
A2B5C14D23 |
-68.73 |
4.78 |
-8.11 |
0.64 |
0 |
|
|
290055 |
104404998 |
1 |
ON4C14H18 |
AB4C14D18 |
1.4 |
7.3 |
-8.4 |
-0.41 |
0 |
|
|
290056 |
104405025 |
1 |
OSN4C14H18 |
ABC4D14E18 |
-0.52 |
3.26 |
-8.42 |
-0.89 |
0 |
|
|
290057 |
104405046 |
1 |
ON4C16H20 |
AB4C16D20 |
-2.63 |
5.16 |
-8.04 |
-0.7 |
0 |
|
|
290058 |
104405073 |
1 |
ON3C14H21 |
AB3C14D21 |
-36.57 |
5.71 |
-8.19 |
0.18 |
0 |
|
|
290059 |
104405109 |
1 |
ON4C15H20 |
AB4C15D20 |
-5.77 |
4.45 |
-8.69 |
-0.63 |
0 |
|
|
290060 |
104405112 |
1 |
ClON3C14H20 |
ABC3D14E20 |
-42.67 |
3.14 |
-8.58 |
-0.16 |
0 |
|
|
290061 |
104405133 |
1 |
ClON4C13H19 |
ABC4D13E19 |
-35.45 |
3.93 |
-8.61 |
-0.41 |
0 |
|
|
290062 |
104405136 |
1 |
ON4C14H22 |
AB4C14D22 |
-36.33 |
3.57 |
-8.02 |
0.05 |
0 |
|
|
290063 |
104405187 |
1 |
O3N4C14H18 |
A3B4C14D18 |
-69.99 |
4.09 |
-8.25 |
-0.24 |
0 |
|
|
290064 |
104405282 |
1 |
ON3C17H33 |
AB3C17D33 |
-78.28 |
5.16 |
-8.6 |
0.98 |
0 |
|
|
290065 |
104405826 |
1 |
N2O4C15H30 |
A2B4C15D30 |
-204.84 |
3.61 |
-9.2 |
0.95 |
0 |
|
|
290066 |
104406121 |
1 |
N2O3C16H28 |
A2B3C16D28 |
-157.91 |
5.99 |
-9.06 |
0.8 |
0 |
|
|
290067 |
104406190 |
1 |
ON3C16H31 |
AB3C16D31 |
-80.09 |
4.65 |
-8.68 |
1.14 |
0 |
|
|
290068 |
104406423 |
1 |
O2N3C12H23 |
A2B3C12D23 |
-118.01 |
1.23 |
-9.33 |
1.03 |
0 |
|
|
290069 |
104406459 |
1 |
O2N3C13H23 |
A2B3C13D23 |
-85.65 |
2.6 |
-9.14 |
0.85 |
0 |
|
|
290070 |
104406564 |
1 |
N3O3C13H23 |
A3B3C13D23 |
-147.08 |
2.71 |
-9.27 |
0.47 |
0 |
|
|
290071 |
104406588 |
1 |
N3O4C12H21 |
A3B4C12D21 |
-181.4 |
1.02 |
-9.37 |
0.28 |
0 |
|
|
290072 |
104406624 |
1 |
FN3C11H18 |
AB3C11D18 |
-18.52 |
2.92 |
-8.79 |
-0.3 |
0 |
|
|
290073 |
104406705 |
1 |
ON2C15H22 |
AB2C15D22 |
-11.87 |
2.58 |
-8.76 |
-0.11 |
0 |
|
|
290074 |
104406783 |
1 |
FN2C13H21 |
AB2C13D21 |
-41.02 |
1.69 |
-8.73 |
0.33 |
0 |
|
|
290075 |
104406816 |
1 |
ClN2C13H21 |
AB2C13D21 |
2.71 |
0.76 |
-8.44 |
-0.02 |
0 |
|
|
290076 |
104406819 |
2 |
N2C5H10 |
A2B5C10 |
25.35 |
1.38 |
-8.63 |
0.98 |
0 |
|
|
290077 |
104406831 |
1 |
FN3C13H22 |
AB3C13D22 |
-31.14 |
2.82 |
-8.68 |
-0.43 |
0 |
|
|
290078 |
104406837 |
1 |
SN2C13H28 |
AB2C13D28 |
-41.29 |
1.65 |
-8.42 |
0.67 |
0 |
|
|
290079 |
104407136 |
1 |
FN2C15H23 |
AB2C15D23 |
-45.67 |
1.55 |
-8.72 |
0.27 |
0 |
|
|
290080 |
104407197 |
1 |
BrN2C16H25 |
AB2C16D25 |
2.83 |
3.61 |
-8.48 |
-0.02 |
0 |
|
|
290081 |
104407243 |
1 |
ON2C18H28 |
AB2C18D28 |
-44.21 |
3.26 |
-8.35 |
0.47 |
0 |
|
|
290082 |
104407521 |
1 |
O2N3C13H21 |
A2B3C13D21 |
-85.63 |
2.85 |
-9.33 |
0.3 |
0 |
|
|
290083 |
104407689 |
1 |
SN3O3C10H17 |
AB3C3D10E17 |
-129.21 |
5.3 |
-8.76 |
-0.28 |
0 |
|
|
290084 |
104407802 |
1 |
OSN4C14H20 |
ABC4D14E20 |
-16.4 |
5.18 |
-8.73 |
-1.13 |
0 |
|
|
290085 |
104407805 |
1 |
BrOSN3C15H20 |
ABCD3E15F20 |
-27.04 |
2.17 |
-8.61 |
-0.88 |
0 |
|
|
290086 |
104407855 |
2 |
ON2C7H13 |
AB2C7D13 |
-109.18 |
1.2 |
-9.07 |
0.99 |
0 |
|
|
290087 |
104407861 |
1 |
O2N3C15H27 |
A2B3C15D27 |
-123.2 |
2.38 |
-8.97 |
0.77 |
0 |
|
|
290088 |
104407863 |
1 |
O3N4C13H24 |
A3B4C13D24 |
-136.76 |
3.16 |
-9.15 |
0.69 |
0 |
|
|
290089 |
104407878 |
1 |
O2N4C11H24 |
A2B4C11D24 |
-76.63 |
4.71 |
-8.79 |
0.91 |
0 |
|
|
290090 |
104407900 |
1 |
O2N4C13H24 |
A2B4C13D24 |
-47.14 |
6.43 |
-8.58 |
0.75 |
0 |
|
|
290091 |
104408000 |
1 |
N3O3C13H17 |
A3B3C13D17 |
-105.36 |
8.17 |
-9.72 |
-0.98 |
0 |
|
|
290092 |
104408003 |
1 |
ClN3O3C14H18 |
AB3C3D14E18 |
-120.92 |
5.2 |
-9.3 |
-1.05 |
0 |
|
|
290093 |
104408122 |
1 |
N3O6C12H19 |
A3B6C12D19 |
-277.16 |
4.05 |
-9.51 |
-0.64 |
0 |
|
|
290094 |
104408183 |
1 |
O3N4C14H18 |
A3B4C14D18 |
-16.47 |
8.04 |
-9.5 |
-1.51 |
0 |
|
|
290095 |
104408218 |
1 |
OF2N3C12H17 |
AB2C3D12E17 |
-119.14 |
2.93 |
-8.93 |
-0.64 |
0 |
|
|
290096 |
104408224 |
1 |
ClON5C13H18 |
ABC5D13E18 |
7.68 |
4.51 |
-8.81 |
-1.0 |
0 |
|
|
290097 |
104408280 |
1 |
O3N4C13H20 |
A3B4C13D20 |
-46.78 |
2.83 |
-9.32 |
-1.24 |
0 |
|
|
290098 |
104408302 |
2 |
ON3C6H9 |
AB3C6D9 |
-31.61 |
4.38 |
-8.81 |
-0.98 |
0 |
|
|
290099 |
104408326 |
1 |
ON4C15H20 |
AB4C15D20 |
4.81 |
2.2 |
-8.65 |
-0.76 |
0 |