List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
134011 |
51625016 |
1 |
O2N3C24H34 |
A2B3C24D34 |
-42.8 |
4.47 |
0.0 |
0.0 |
1 |
|
|
134012 |
51625050 |
1 |
O2N4C19H27 |
A2B4C19D27 |
-43.44 |
5.39 |
0.0 |
0.0 |
1 |
|
|
134013 |
51625638 |
1 |
O2N6C26H37 |
A2B6C26D37 |
50.82 |
4.54 |
0.0 |
0.0 |
1 |
|
|
134014 |
51625731 |
1 |
ON7C26H36 |
AB7C26D36 |
100.25 |
4.96 |
0.0 |
0.0 |
0 |
|
|
134015 |
51625732 |
1 |
ON7C26H35 |
AB7C26D35 |
78.74 |
8.4 |
-8.29 |
-0.09 |
1 |
|
|
134016 |
51625892 |
1 |
FN6C26H28 |
AB6C26D28 |
112.57 |
3.81 |
0.0 |
0.0 |
0 |
|
|
134017 |
51625893 |
1 |
FN6C26H27 |
AB6C26D27 |
110.65 |
5.91 |
-8.7 |
-0.65 |
1 |
|
|
134018 |
51625894 |
1 |
FN6C26H28 |
AB6C26D28 |
129.98 |
8.81 |
0.0 |
0.0 |
0 |
|
|
134019 |
51625895 |
1 |
FN6C26H27 |
AB6C26D27 |
113.94 |
6.99 |
-8.93 |
-0.86 |
0 |
|
|
134020 |
51625997 |
2 |
ON3C14H16 |
AB3C14D16 |
79.17 |
5.54 |
-8.88 |
-0.27 |
1 |
|
|
134021 |
51626078 |
1 |
O4N6C24H31 |
A4B6C24D31 |
16.69 |
7.47 |
0.0 |
0.0 |
1 |
|
|
134022 |
51626415 |
1 |
N4O4C19H27 |
A4B4C19D27 |
-59.95 |
5.63 |
0.0 |
0.0 |
0 |
|
|
134023 |
51626425 |
2 |
NOC11H18 |
ABC11D18 |
-94.17 |
2.82 |
-8.72 |
0.32 |
1 |
|
|
134024 |
51626970 |
1 |
O2N4C21H33 |
A2B4C21D33 |
-63.49 |
4.83 |
0.0 |
0.0 |
0 |
|
|
134025 |
51626971 |
1 |
O2N4C21H32 |
A2B4C21D32 |
-78.25 |
10.1 |
-8.42 |
0.41 |
1 |
|
|
134026 |
51626972 |
1 |
ClO2F3N4C22H31 |
AB2C3D4E22F31 |
-239.32 |
7.9 |
0.0 |
0.0 |
0 |
|
|
134027 |
51626973 |
1 |
ClO2F3N4C22H30 |
AB2C3D4E22F30 |
-261.49 |
7.95 |
-9.13 |
-0.91 |
1 |
|
|
134028 |
51626974 |
1 |
ClO2F3N4C22H31 |
AB2C3D4E22F31 |
-242.94 |
9.55 |
0.0 |
0.0 |
1 |
|
|
134029 |
51627657 |
1 |
Br2O2N3C18H22 |
A2B2C3D18E22 |
-15.06 |
4.94 |
0.0 |
0.0 |
0 |
|
|
134030 |
51627790 |
1 |
N2O2C23H32 |
A2B2C23D32 |
-42.77 |
1.65 |
-8.18 |
0.22 |
1 |
|
|
134031 |
51627791 |
1 |
N2O2C23H33 |
A2B2C23D33 |
-30.8 |
5.02 |
0.0 |
0.0 |
0 |
|
|
134032 |
51627884 |
1 |
ClON2C21H27 |
ABC2D21E27 |
-9.34 |
1.86 |
-8.69 |
-0.14 |
0 |
|
|
134033 |
51627912 |
1 |
N2C13H20 |
A2B13C20 |
16.91 |
0.76 |
-8.7 |
0.58 |
0 |
|
|
134034 |
51628515 |
1 |
BrN2O2C22H29 |
AB2C2D22E29 |
-32.23 |
1.48 |
-8.59 |
-0.15 |
0 |
|
|
134035 |
51628598 |
3 |
NOC8H11 |
ABC8D11 |
-84.09 |
3.83 |
-8.57 |
-0.27 |
2 |
|
|
134036 |
51628599 |
1 |
ON4C18H26 |
AB4C18D26 |
33.43 |
4.43 |
-8.85 |
-0.61 |
0 |
|
|
134037 |
51628600 |
1 |
ON4C18H24 |
AB4C18D24 |
28.4 |
1.98 |
-8.76 |
-0.52 |
2 |
|
|
134038 |
51628601 |
1 |
ON4C18H26 |
AB4C18D26 |
30.28 |
1.98 |
-8.65 |
-0.63 |
1 |
|
|
134039 |
51629391 |
1 |
N3O4C20H26 |
A3B4C20D26 |
-100.84 |
3.47 |
0.0 |
0.0 |
1 |
|
|
134040 |
51629392 |
1 |
OSN4C20H27 |
ABC4D20E27 |
26.91 |
4.24 |
0.0 |
0.0 |
1 |
|
|
134041 |
51629393 |
1 |
ON4C18H23 |
AB4C18D23 |
36.28 |
5.39 |
0.0 |
0.0 |
0 |
|
|
134042 |
51629459 |
1 |
ClNO3C19H20 |
ABC3D19E20 |
-109.87 |
2.87 |
-9.24 |
-0.47 |
0 |
|
|
134043 |
51630421 |
1 |
S2N3O4H19C20 |
A2B3C4D19E20 |
-10.82 |
3.31 |
-8.55 |
-1.79 |
0 |
|
|
134044 |
51630448 |
1 |
ClO3N5C25H32 |
AB3C5D25E32 |
-115.16 |
6.18 |
-9.24 |
-1.44 |
1 |
|
|
134045 |
51630740 |
1 |
SO3N4C20H33 |
AB3C4D20E33 |
-94.91 |
5.45 |
0.0 |
0.0 |
0 |
|
|
134046 |
51631279 |
1 |
O3N5C23H31 |
A3B5C23D31 |
-65.13 |
5.75 |
-8.63 |
-0.25 |
-1 |
|
|
134047 |
51631319 |
1 |
BrN2O4H16C24 |
AB2C4D16E24 |
16.5 |
3.04 |
0.0 |
0.0 |
0 |
|
|
134048 |
51631576 |
1 |
N5C20H29 |
A5B20C29 |
76.02 |
3.61 |
-8.38 |
-0.08 |
1 |
|
|
134049 |
51632319 |
1 |
OSN3C19H26 |
ABC3D19E26 |
17.35 |
3.48 |
0.0 |
0.0 |
0 |
|
|
134050 |
51633273 |
1 |
O2N5C23H39 |
A2B5C23D39 |
-82.72 |
5.94 |
-8.49 |
0.34 |
1 |
|
|
134051 |
51633282 |
1 |
O2N5C23H38 |
A2B5C23D38 |
-27.39 |
4.24 |
0.0 |
0.0 |
1 |
|
|
134052 |
51633296 |
1 |
O2N5C26H44 |
A2B5C26D44 |
-50.96 |
4.45 |
0.0 |
0.0 |
0 |
|
|
134053 |
51633586 |
1 |
ON4C21H30 |
AB4C21D30 |
11.55 |
2.07 |
-8.69 |
-0.09 |
1 |
|
|
134054 |
51634001 |
1 |
N3O3C23H40 |
A3B3C23D40 |
-89.22 |
2.39 |
0.0 |
0.0 |
0 |
|
|
134055 |
51634002 |
1 |
N3O3C23H39 |
A3B3C23D39 |
-108.46 |
5.19 |
-8.25 |
0.24 |
0 |
|
|
134056 |
51634024 |
1 |
FON2C17H25 |
ABC2D17E25 |
-71.35 |
3.23 |
-8.47 |
0.28 |
1 |
|
|
134057 |
51634832 |
1 |
OF2N3C18H28 |
AB2C3D18E28 |
-115.57 |
3.73 |
0.0 |
0.0 |
2 |
|
|
134058 |
51635259 |
1 |
O3N5C23H39 |
A3B5C23D39 |
-43.34 |
19.09 |
-6.55 |
-0.76 |
1 |
|
|
134059 |
51635403 |
1 |
ClO2N3C24H29 |
AB2C3D24E29 |
-2.6 |
7.11 |
0.0 |
0.0 |
1 |
|
|
134060 |
51635437 |
1 |
O3N4C24H39 |
A3B4C24D39 |
-81.31 |
5.12 |
0.0 |
0.0 |
1 |
|
|
134061 |
51635676 |
1 |
N5C23H30 |
A5B23C30 |
122.85 |
2.54 |
0.0 |
0.0 |
1 |
|
|
134062 |
51635706 |
1 |
N2O4C25H37 |
A2B4C25D37 |
-105.78 |
5.64 |
0.0 |
0.0 |
1 |
|
|
134063 |
51636137 |
1 |
N3O4C18H30 |
A3B4C18D30 |
-138.78 |
4.83 |
0.0 |
0.0 |
1 |
|
|
134064 |
51636176 |
1 |
N2O3C21H35 |
A2B3C21D35 |
-101.65 |
1.94 |
0.0 |
0.0 |
0 |
|
|
134065 |
51636177 |
1 |
N2O3C21H34 |
A2B3C21D34 |
-128.44 |
6.19 |
-8.54 |
0.11 |
0 |
|
|
134066 |
51636267 |
1 |
SO2N4C22H34 |
AB2C4D22E34 |
-56.71 |
4.22 |
-8.7 |
0.22 |
0 |
|
|
134067 |
51636323 |
1 |
N3O4C22H37 |
A3B4C22D37 |
-159.46 |
3.01 |
-8.35 |
0.24 |
2 |
|
|
134068 |
51636324 |
1 |
N3O4C22H39 |
A3B4C22D39 |
-168.94 |
0.87 |
-8.54 |
0.08 |
2 |
|
|
134069 |
51636403 |
1 |
F3N3C19H32 |
A3B3C19D32 |
-121.08 |
14.0 |
-6.41 |
-0.35 |
0 |
|
|
134070 |
51636484 |
1 |
FN2O3C24H33 |
AB2C3D24E33 |
-123.2 |
3.83 |
-8.07 |
0.2 |
1 |
|
|
134071 |
51636717 |
1 |
N3O5C19H28 |
A3B5C19D28 |
-92.8 |
6.01 |
0.0 |
0.0 |
0 |
|
|
134072 |
51636919 |
2 |
NO2C13H13 |
AB2C13D13 |
-90.9 |
2.9 |
-8.71 |
-1.36 |
0 |
|
|
134073 |
51636928 |
1 |
N4O7C21H22 |
A4B7C21D22 |
-158.99 |
5.25 |
-8.49 |
-1.76 |
0 |
|
|
134074 |
51636929 |
1 |
N4O7C21H22 |
A4B7C21D22 |
-156.73 |
8.29 |
-8.62 |
-1.52 |
0 |
|
|
134075 |
51637066 |
1 |
SO3N4C23H26 |
AB3C4D23E26 |
-90.48 |
5.2 |
-9.19 |
-0.98 |
0 |
|
|
134076 |
51637293 |
1 |
BrNO4C18H18 |
ABC4D18E18 |
-104.93 |
3.05 |
-8.76 |
-0.28 |
0 |
|
|
134077 |
51637626 |
1 |
N2C23H26 |
A2B23C26 |
59.75 |
1.18 |
-8.15 |
-0.84 |
0 |
|
|
134078 |
51638165 |
1 |
NOC11H13 |
ABC11D13 |
-30.84 |
4.67 |
-9.58 |
0.18 |
0 |
|
|
134079 |
51638166 |
1 |
N2F3O4C19H21 |
A2B3C4D19E21 |
-320.3 |
5.23 |
-9.34 |
-0.31 |
0 |
|
|
134080 |
51638167 |
1 |
O2S3N4C22H26 |
A2B3C4D22E26 |
-5.75 |
4.52 |
-8.61 |
-1.06 |
0 |
|
|
134081 |
51638168 |
1 |
O2S3N4C22H26 |
A2B3C4D22E26 |
-5.72 |
4.45 |
-8.61 |
-1.05 |
0 |
|
|
134082 |
51638601 |
1 |
FSN3O5C21H28 |
ABC3D5E21F28 |
-275.97 |
8.93 |
-8.67 |
-0.35 |
0 |
|
|
134083 |
51639711 |
2 |
NOC8H10 |
ABC8D10 |
-44.51 |
3.97 |
-9.49 |
-0.68 |
0 |
|
|
134084 |
51639712 |
1 |
BrN2O2C12H15 |
AB2C2D12E15 |
-72.63 |
3.95 |
-9.82 |
-0.74 |
-1 |
|
|
134085 |
51639713 |
1 |
BrSN2O3H18C21 |
ABC2D3E18F21 |
-15.77 |
5.74 |
0.0 |
0.0 |
1 |
|
|
134086 |
51639714 |
1 |
O2N5C15H24 |
A2B5C15D24 |
-60.56 |
3.89 |
0.0 |
0.0 |
0 |
|
|
134087 |
51640545 |
1 |
N2O3C22H28 |
A2B3C22D28 |
-89.42 |
4.27 |
-8.65 |
-0.39 |
0 |
|
|
134088 |
51640796 |
1 |
OBr2N2C15H20 |
AB2C2D15E20 |
-37.42 |
3.5 |
-9.03 |
-0.63 |
0 |
|
|
134089 |
51640963 |
1 |
ClFO2N5C24H29 |
ABC2D5E24F29 |
-81.79 |
3.59 |
-8.33 |
-0.98 |
1 |
|
|
134090 |
51642140 |
1 |
ClFSO2N3H20C22 |
ABCD2E3F20G22 |
-28.76 |
7.46 |
0.0 |
0.0 |
0 |
|
|
134091 |
51642509 |
1 |
OSF3N5C17H20 |
ABC3D5E17F20 |
-128.49 |
6.19 |
-9.3 |
-0.97 |
0 |
|
|
134092 |
51642510 |
1 |
S2N3O4C23H27 |
A2B3C4D23E27 |
-67.92 |
8.4 |
-9.05 |
-0.86 |
0 |
|
|
134093 |
51642531 |
1 |
S2N3O5C23H31 |
A2B3C5D23E31 |
-162.39 |
6.17 |
-8.58 |
-1.3 |
2 |
|
|
134094 |
51642910 |
1 |
O3N4C28H36 |
A3B4C28D36 |
-10.15 |
18.2 |
-6.31 |
-1.73 |
1 |
|
|
134095 |
51643048 |
1 |
ClSO2N5C24H29 |
ABC2D5E24F29 |
12.04 |
7.49 |
0.0 |
0.0 |
0 |
|
|
134096 |
51643559 |
1 |
ClOS2N5C22H24 |
ABC2D5E22F24 |
51.1 |
2.59 |
-8.65 |
-1.17 |
0 |
|
|
134097 |
51643659 |
1 |
N2O5C23H26 |
A2B5C23D26 |
-120.54 |
5.77 |
-8.93 |
-1.29 |
0 |
|
|
134098 |
51643789 |
1 |
S2N3O4C23H31 |
A2B3C4D23E31 |
-126.26 |
3.94 |
-8.99 |
-0.65 |
0 |
|
|
134099 |
51644054 |
1 |
SN3O3C20H29 |
AB3C3D20E29 |
-111.67 |
12.44 |
-9.72 |
-1.01 |
0 |
|
|
134100 |
51644055 |
1 |
SN3O3C20H29 |
AB3C3D20E29 |
-112.43 |
7.59 |
-9.75 |
-1.15 |
0 |
|
|
134101 |
51644056 |
1 |
SN3O3C20H29 |
AB3C3D20E29 |
-114.43 |
6.33 |
-9.64 |
-1.23 |
0 |
|
|
134102 |
51644151 |
1 |
F2N2S2O3C22H24 |
A2B2C2D3E22F24 |
-182.78 |
4.33 |
-8.81 |
-1.02 |
0 |
|
|
134103 |
51644436 |
1 |
FO4N5H20C23 |
AB4C5D20E23 |
-83.16 |
7.07 |
-9.62 |
-1.04 |
0 |
|
|
134104 |
51644536 |
1 |
FNSO3H18C19 |
ABCD3E18F19 |
-80.3 |
2.9 |
-9.19 |
-0.63 |
0 |
|
|
134105 |
51644582 |
1 |
ON5C23H37 |
AB5C23D37 |
-13.35 |
5.47 |
-8.8 |
-0.14 |
1 |
|
|
134106 |
51644583 |
1 |
ON5C23H38 |
AB5C23D38 |
8.46 |
7.31 |
0.0 |
0.0 |
0 |
|
|
134107 |
51644584 |
1 |
ON5C23H37 |
AB5C23D37 |
-15.87 |
6.27 |
-8.92 |
0.02 |
0 |
|
|
134108 |
51644614 |
1 |
N4O5C26H28 |
A4B5C26D28 |
-148.26 |
1.78 |
-8.77 |
-0.76 |
-3 |
|
|
134109 |
51644615 |
1 |
S2N6O12C20H29 |
A2B6C12D20E29 |
-479.07 |
6.61 |
0.0 |
0.0 |
0 |
|
|
134110 |
51644918 |
1 |
NSO6C23H31 |
ABC6D23E31 |
-240.71 |
9.3 |
-9.02 |
-0.87 |
0 |