List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
80942 |
49853996 |
1 |
O2N5H15C19 |
A2B5C15D19 |
85.11 |
9.27 |
-8.71 |
-1.46 |
0 |
|
|
80943 |
49854008 |
1 |
N3O4C23H31 |
A3B4C23D31 |
-139.33 |
6.45 |
-8.71 |
-0.32 |
0 |
|
|
80944 |
49854011 |
2 |
FN2O3C13H18 |
AB2C3D13E18 |
-316.46 |
6.59 |
-8.79 |
-0.47 |
0 |
|
|
80945 |
49854018 |
1 |
O3N6H22C23 |
A3B6C22D23 |
21.41 |
6.96 |
-9.18 |
-0.6 |
0 |
|
|
80946 |
49854022 |
1 |
F2O3N4C17H18 |
A2B3C4D17E18 |
-173.12 |
5.95 |
-9.24 |
-0.76 |
0 |
|
|
80947 |
49854026 |
1 |
F2O3N4H14C16 |
A2B3C4D14E16 |
-120.57 |
8.16 |
-9.51 |
-1.48 |
0 |
|
|
80948 |
49854032 |
1 |
F2O2N5H15C16 |
A2B2C5D15E16 |
-91.05 |
5.17 |
-9.36 |
-1.21 |
0 |
|
|
80949 |
49854053 |
1 |
SO2N7C20H27 |
AB2C7D20E27 |
-39.73 |
3.53 |
-8.51 |
-1.03 |
0 |
|
|
80950 |
49854054 |
1 |
NO9C31H39 |
AB9C31D39 |
-393.98 |
5.28 |
-9.78 |
-1.52 |
0 |
|
|
80951 |
49854059 |
1 |
NSF2O4C19H21 |
ABC2D4E19F21 |
-217.4 |
4.17 |
-9.17 |
-0.55 |
0 |
|
|
80952 |
49854073 |
1 |
S2O4N5H23C25 |
A2B4C5D23E25 |
-49.37 |
11.9 |
-8.99 |
-1.77 |
0 |
|
|
80953 |
49854103 |
1 |
O2F3N5H18C21 |
A2B3C5D18E21 |
-103.31 |
3.78 |
-8.8 |
-1.4 |
0 |
|
|
80954 |
49854109 |
1 |
NO4C16H21 |
AB4C16D21 |
-142.93 |
1.72 |
-9.13 |
-1.16 |
0 |
|
|
80955 |
49854117 |
1 |
ON2C24H30 |
AB2C24D30 |
7.41 |
1.15 |
-8.29 |
0.21 |
0 |
|
|
80956 |
49854118 |
1 |
ON2C16H20 |
AB2C16D20 |
-0.04 |
0.82 |
-8.54 |
0.13 |
0 |
|
|
80957 |
49854119 |
1 |
O3N4C20H24 |
A3B4C20D24 |
-72.23 |
4.06 |
-9.05 |
-0.69 |
0 |
|
|
80958 |
49854120 |
2 |
N2O2C9H9 |
A2B2C9D9 |
-86.65 |
5.87 |
-9.18 |
-0.89 |
0 |
|
|
80959 |
49854125 |
2 |
N2O2C9H10 |
A2B2C9D10 |
-110.97 |
6.15 |
-9.3 |
-0.6 |
0 |
|
|
80960 |
49854128 |
1 |
F2O2N5H15C16 |
A2B2C5D15E16 |
-95.69 |
4.18 |
-9.59 |
-1.11 |
0 |
|
|
80961 |
49854130 |
1 |
O2N5C22H27 |
A2B5C22D27 |
-21.66 |
6.55 |
-9.1 |
-0.49 |
0 |
|
|
80962 |
49854132 |
1 |
BrFO2N5H15C16 |
ABC2D5E15F16 |
-47.5 |
5.1 |
-9.37 |
-1.29 |
0 |
|
|
80963 |
49854137 |
1 |
MnSiH4 |
ABC4 |
70.37 |
0.0 |
0.0 |
0.0 |
0 |
|
|
80964 |
49854138 |
1 |
ZrCl2N2O2C34H36 |
AB2C2D2E34F36 |
-15.46 |
3.86 |
-5.93 |
-1.82 |
0 |
|
|
80965 |
49854139 |
1 |
ClSN5O6C24H28 |
ABC5D6E24F28 |
-183.53 |
7.51 |
-8.39 |
-0.59 |
0 |
|
|
80966 |
49854142 |
1 |
ClSO5N6C21H23 |
ABC5D6E21F23 |
-125.86 |
8.42 |
-8.54 |
-0.46 |
0 |
|
|
80967 |
49854144 |
1 |
S2N9O11C31H41 |
A2B9C11D31E41 |
-363.66 |
6.15 |
-9.14 |
-1.76 |
0 |
|
|
80968 |
49854147 |
1 |
SN6O13C31H42 |
AB6C13D31E42 |
-531.52 |
8.09 |
-8.98 |
-0.73 |
0 |
|
|
80969 |
49854154 |
1 |
FSO2N7C19H24 |
ABC2D7E19F24 |
-78.68 |
3.69 |
-8.56 |
-1.1 |
0 |
|
|
80970 |
49854159 |
1 |
SO2N7C20H27 |
AB2C7D20E27 |
-35.95 |
3.15 |
-8.51 |
-1.03 |
0 |
|
|
80971 |
49854161 |
3 |
NO3C12H13 |
AB3C12D13 |
-312.73 |
5.73 |
-9.72 |
-1.44 |
0 |
|
|
80972 |
49854171 |
1 |
ON3C20H23 |
AB3C20D23 |
7.63 |
1.88 |
-8.26 |
-0.04 |
0 |
|
|
80973 |
49854173 |
1 |
ClSO2F3N3C19H21 |
ABC2D3E3F19G21 |
-213.63 |
3.32 |
-9.12 |
-1.17 |
0 |
|
|
80974 |
49854175 |
1 |
ClSF3N3O4C31H35 |
ABC3D3E4F31G35 |
-265.91 |
6.0 |
-8.75 |
-1.32 |
0 |
|
|
80975 |
49854178 |
1 |
SN4O4C27H30 |
AB4C4D27E30 |
-102.96 |
8.37 |
-8.8 |
-1.68 |
0 |
|
|
80976 |
49854183 |
1 |
N3O4C41H55 |
A3B4C41D55 |
-147.32 |
5.8 |
-8.33 |
-0.25 |
0 |
|
|
80977 |
49854188 |
1 |
ON3C16H31 |
AB3C16D31 |
-86.11 |
4.04 |
-8.59 |
1.24 |
0 |
|
|
80978 |
49854189 |
1 |
O2N3C24H43 |
A2B3C24D43 |
-146.81 |
2.79 |
-8.89 |
1.01 |
0 |
|
|
80979 |
49854192 |
1 |
OF2N3C16H29 |
AB2C3D16E29 |
-186.8 |
3.58 |
-8.8 |
0.95 |
0 |
|
|
80980 |
49854203 |
1 |
O4N5C25H25 |
A4B5C25D25 |
-23.52 |
3.59 |
-8.89 |
-1.66 |
0 |
|
|
80981 |
49854208 |
1 |
NO4C16H25 |
AB4C16D25 |
-181.29 |
5.91 |
-8.84 |
-0.23 |
0 |
|
|
80982 |
49854210 |
1 |
NO2C16H23 |
AB2C16D23 |
-86.04 |
2.22 |
-9.42 |
-0.44 |
0 |
|
|
80983 |
49854211 |
1 |
N3O4H21C23 |
A3B4C21D23 |
-110.48 |
6.07 |
-9.19 |
-0.85 |
0 |
|
|
80984 |
49854218 |
1 |
N3C20H31 |
A3B20C31 |
31.01 |
3.14 |
-8.46 |
0.26 |
0 |
|
|
80985 |
49854219 |
1 |
Cl2N3C21H23 |
A2B3C21D23 |
61.1 |
2.59 |
-8.42 |
-0.28 |
0 |
|
|
80986 |
49854220 |
1 |
ON3C21H31 |
AB3C21D31 |
-15.59 |
3.07 |
-8.5 |
0.2 |
0 |
|
|
80987 |
49854221 |
1 |
ON3C20H29 |
AB3C20D29 |
-13.97 |
3.41 |
-8.28 |
0.27 |
0 |
|
|
80988 |
49854224 |
1 |
F3O3N4C18H19 |
A3B3C4D18E19 |
-233.58 |
5.86 |
-9.31 |
-0.87 |
0 |
|
|
80989 |
49854226 |
1 |
O3N4C19H22 |
A3B4C19D22 |
-73.31 |
8.07 |
-9.13 |
-0.43 |
0 |
|
|
80990 |
49854230 |
1 |
F2O2N5C17H17 |
A2B2C5D17E17 |
-93.26 |
5.39 |
-9.44 |
-0.94 |
0 |
|
|
80991 |
49854231 |
1 |
Cl2O2N5C17H17 |
A2B2C5D17E17 |
-19.23 |
3.26 |
-9.36 |
-1.06 |
0 |
|
|
80992 |
49854232 |
1 |
O2F3N5H16C17 |
A2B3C5D16E17 |
-136.96 |
3.83 |
-9.58 |
-1.23 |
0 |
|
|
80993 |
49854233 |
4 |
NOC4H4 |
ABC4D4 |
-78.84 |
6.62 |
-9.5 |
-1.02 |
0 |
|
|
80994 |
49854234 |
1 |
BrO2N5C17H18 |
AB2C5D17E18 |
-1.78 |
5.8 |
-9.29 |
-0.86 |
0 |
|
|
80995 |
49854235 |
1 |
O3N4H20C24 |
A3B4C20D24 |
-29.95 |
5.6 |
-9.29 |
-0.88 |
1 |
|
|
80996 |
49854236 |
1 |
SN4O6C41H45 |
AB4C6D41E45 |
-72.52 |
6.08 |
0.0 |
0.0 |
1 |
|
|
80997 |
49854237 |
1 |
SO3N5C35H40 |
AB3C5D35E40 |
44.13 |
11.0 |
0.0 |
0.0 |
0 |
|
|
80998 |
49854238 |
1 |
SN3O3C36H41 |
AB3C3D36E41 |
46.36 |
12.36 |
-7.29 |
-1.2 |
1 |
|
|
80999 |
49854239 |
1 |
SN3O3C36H42 |
AB3C3D36E42 |
16.73 |
8.11 |
0.0 |
0.0 |
0 |
|
|
81000 |
49854240 |
1 |
SN5O5C43H49 |
AB5C5D43E49 |
-22.67 |
19.82 |
-8.56 |
-2.16 |
1 |
|
|
81001 |
49854241 |
1 |
SN5O5C43H50 |
AB5C5D43E50 |
-74.97 |
5.25 |
0.0 |
0.0 |
0 |
|
|
81002 |
49854242 |
1 |
FeCl2N5C21H25 |
AB2C5D21E25 |
141.74 |
3.57 |
-8.33 |
-1.1 |
0 |
|
|
81003 |
49854243 |
1 |
O12C31H42 |
A12B31C42 |
-499.06 |
3.35 |
-9.52 |
0.1 |
0 |
|
|
81004 |
49854244 |
1 |
O2C17H34 |
A2B17C34 |
-165.08 |
2.14 |
-10.55 |
0.91 |
0 |
|
|
81005 |
49854245 |
1 |
NO3C5H9 |
AB3C5D9 |
-127.84 |
1.48 |
-10.18 |
-0.73 |
0 |
|
|
81006 |
49854246 |
1 |
ClSN5O5C22H26 |
ABC5D5E22F26 |
-138.99 |
9.23 |
-8.43 |
-0.44 |
0 |
|
|
81007 |
49854247 |
1 |
ClSN5O5C22H26 |
ABC5D5E22F26 |
-133.35 |
8.08 |
-8.34 |
-0.44 |
0 |
|
|
81008 |
49854248 |
1 |
ClSN5O5C23H28 |
ABC5D5E23F28 |
-150.05 |
4.57 |
-8.66 |
-0.64 |
0 |
|
|
81009 |
49854249 |
1 |
ClSN5O6C21H24 |
ABC5D6E21F24 |
-165.14 |
2.49 |
-8.65 |
-0.78 |
0 |
|
|
81010 |
49854250 |
1 |
ClSO4N5C22H26 |
ABC4D5E22F26 |
-96.34 |
2.34 |
-8.31 |
-0.54 |
0 |
|
|
81011 |
49854251 |
1 |
SN6O12C35H44 |
AB6C12D35E44 |
-451.49 |
11.97 |
-9.28 |
-0.9 |
0 |
|
|
81012 |
49854252 |
1 |
SN7O12C33H43 |
AB7C12D33E43 |
-460.31 |
8.21 |
-8.43 |
-0.67 |
0 |
|
|
81013 |
49854253 |
1 |
S2N8O12C25H34 |
A2B8C12D25E34 |
-440.45 |
11.84 |
-9.44 |
-1.46 |
0 |
|
|
81014 |
49854254 |
1 |
S2N8O13C25H34 |
A2B8C13D25E34 |
-426.75 |
8.94 |
-8.83 |
-1.67 |
0 |
|
|
81015 |
49854255 |
1 |
SN4O5H22C23 |
AB4C5D22E23 |
-74.12 |
8.49 |
-9.0 |
-1.14 |
0 |
|
|
81016 |
49854256 |
1 |
SN4O5C24H24 |
AB4C5D24E24 |
-78.52 |
5.97 |
-9.0 |
-1.21 |
0 |