List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
321921 |
126667384 |
1 |
N2O3H16C19 |
A2B3C16D19 |
-50.77 |
2.76 |
-9.09 |
-1.19 |
0 |
|
|
321922 |
126667386 |
1 |
NO3H11C18 |
AB3C11D18 |
-33.62 |
7.84 |
-9.67 |
-1.48 |
0 |
|
|
321923 |
126667387 |
1 |
NO4H9C16 |
AB4C9D16 |
-64.16 |
5.7 |
-9.78 |
-1.64 |
0 |
|
|
321924 |
126667391 |
1 |
N2O3H10C16 |
A2B3C10D16 |
-37.73 |
7.03 |
-9.31 |
-1.44 |
0 |
|
|
321925 |
126667394 |
1 |
N3O3H11C16 |
A3B3C11D16 |
-14.44 |
8.37 |
-9.48 |
-1.49 |
0 |
|
|
321926 |
126667395 |
1 |
NO3H11C16 |
AB3C11D16 |
-31.49 |
8.26 |
-10.01 |
-1.35 |
0 |
|
|
321927 |
126667396 |
1 |
N2O3H10C17 |
A2B3C10D17 |
-15.99 |
4.96 |
-9.46 |
-1.54 |
0 |
|
|
321928 |
126667397 |
1 |
N2O3H10C17 |
A2B3C10D17 |
-21.33 |
9.85 |
-9.88 |
-1.79 |
0 |
|
|
321929 |
126667398 |
1 |
N2F3O3H11C18 |
A2B3C3D11E18 |
-194.5 |
3.61 |
-9.55 |
-1.55 |
0 |
|
|
321930 |
126667400 |
1 |
N2F3O3H9C18 |
A2B3C3D9E18 |
-181.31 |
6.66 |
-9.76 |
-2.18 |
0 |
|
|
321931 |
126667401 |
1 |
NO5H13C18 |
AB5C13D18 |
-131.59 |
7.69 |
-9.86 |
-1.78 |
0 |
|
|
321932 |
126667403 |
1 |
NO3H13C17 |
AB3C13D17 |
-62.98 |
8.08 |
-9.95 |
-1.16 |
0 |
|
|
321933 |
126667406 |
1 |
O2C13H22 |
A2B13C22 |
-102.55 |
2.21 |
-9.28 |
1.14 |
0 |
|
|
321934 |
126667408 |
1 |
O3N7C26H27 |
A3B7C26D27 |
57.73 |
7.3 |
-8.26 |
-0.99 |
0 |
|
|
321935 |
126667409 |
1 |
ON4C5H8 |
AB4C5D8 |
94.5 |
4.05 |
-9.5 |
-1.11 |
0 |
|
|
321936 |
126667410 |
1 |
O4N7C25H27 |
A4B7C25D27 |
66.74 |
9.89 |
-8.52 |
-0.95 |
0 |
|
|
321937 |
126667411 |
1 |
O3N7C28H31 |
A3B7C28D31 |
49.57 |
10.39 |
-8.14 |
-0.85 |
0 |
|
|
321938 |
126667415 |
1 |
F2O2N7C23H23 |
A2B2C7D23E23 |
-13.92 |
6.07 |
-8.27 |
-1.25 |
0 |
|
|
321939 |
126667419 |
1 |
F2O2N7C25H27 |
A2B2C7D25E27 |
-33.96 |
7.14 |
-8.37 |
-1.12 |
0 |
|
|
321940 |
126667426 |
1 |
F2O3N8C24H24 |
A2B3C8D24E24 |
-28.17 |
7.37 |
-8.41 |
-1.37 |
0 |
|
|
321941 |
126667431 |
1 |
F2O2N8C29H32 |
A2B2C8D29E32 |
-53.65 |
11.85 |
-8.13 |
-0.44 |
0 |
|
|
321942 |
126667432 |
1 |
SF2O3N8C22H24 |
AB2C3D8E22F24 |
-7.08 |
4.25 |
-8.52 |
-0.9 |
0 |
|
|
321943 |
126667436 |
1 |
OSF2N7C22H25 |
ABC2D7E22F25 |
-4.36 |
8.65 |
-7.87 |
-0.4 |
0 |
|
|
321944 |
126667437 |
1 |
OSF2N8C22H24 |
ABC2D8E22F24 |
-3.53 |
4.35 |
-8.23 |
-0.7 |
0 |
|
|
321945 |
126667438 |
1 |
SF2O2N8C25H26 |
AB2C2D8E25F26 |
-23.44 |
1.61 |
-8.4 |
-0.65 |
0 |
|
|
321946 |
126667439 |
1 |
OSF2N8C22H24 |
ABC2D8E22F24 |
12.1 |
8.77 |
-8.02 |
-0.62 |
0 |
|
|
321947 |
126667442 |
1 |
OSF2N8C24H26 |
ABC2D8E24F26 |
5.77 |
3.49 |
-7.98 |
-0.63 |
0 |
|
|
321948 |
126667453 |
1 |
N5H11C12 |
A5B11C12 |
103.31 |
6.75 |
-8.62 |
-0.84 |
0 |
|
|
321949 |
126667473 |
1 |
NO4C21H25 |
AB4C21D25 |
-124.74 |
1.39 |
-9.47 |
-0.04 |
0 |
|
|
321950 |
126667486 |
1 |
N2O3H12C17 |
A2B3C12D17 |
-35.23 |
10.98 |
-9.12 |
-1.28 |
0 |
|
|
321951 |
126667490 |
1 |
NH4F5C6 |
AB4C5D6 |
-225.21 |
2.78 |
-11.74 |
-1.56 |
0 |
|
|
321952 |
126667496 |
1 |
PO6C8H9 |
AB6C8D9 |
-305.71 |
6.08 |
-10.02 |
-0.64 |
0 |
|
|
321953 |
126667499 |
1 |
O3N7C26H29 |
A3B7C26D29 |
54.55 |
9.8 |
-7.88 |
-0.86 |
0 |
|
|
321954 |
126667500 |
1 |
O2N7C23H25 |
A2B7C23D25 |
81.31 |
2.32 |
-8.13 |
-1.12 |
0 |
|
|
321955 |
126667510 |
1 |
O3N8C24H28 |
A3B8C24D28 |
78.79 |
3.66 |
-8.63 |
-0.64 |
0 |
|
|
321956 |
126667511 |
1 |
O3N8C24H26 |
A3B8C24D26 |
79.65 |
10.59 |
-8.18 |
-0.66 |
0 |
|
|
321957 |
126667512 |
1 |
O2N8C27H30 |
A2B8C27D30 |
74.09 |
11.02 |
-7.88 |
-0.26 |
0 |
|
|
321958 |
126667513 |
1 |
O3N8C26H28 |
A3B8C26D28 |
86.26 |
10.39 |
-8.11 |
-0.53 |
0 |
|
|
321959 |
126667524 |
1 |
SF3O3N6H11C17 |
AB3C3D6E11F17 |
-53.21 |
10.88 |
-8.75 |
-1.68 |
0 |
|
|
321960 |
126667534 |
1 |
ClFIO2H4N5C9 |
ABCD2E4F5G9 |
53.02 |
4.79 |
-9.98 |
-2.16 |
0 |
|
|
321961 |
126667537 |
2 |
ON4C13H14 |
AB4C13D14 |
63.37 |
6.07 |
-8.23 |
-0.79 |
0 |
|
|
321962 |
126667540 |
1 |
O2N7C24H27 |
A2B7C24D27 |
97.14 |
5.68 |
-8.7 |
-0.62 |
0 |
|
|
321963 |
126667541 |
1 |
O3C8H10 |
A3B8C10 |
-96.67 |
4.87 |
-9.95 |
-1.28 |
0 |
|
|
321964 |
126667542 |
2 |
ON4C11H14 |
AB4C11D14 |
76.71 |
6.61 |
-8.48 |
-0.47 |
0 |
|
|
321965 |
126667545 |
1 |
ON8C24H32 |
AB8C24D32 |
78.81 |
2.71 |
-7.93 |
-0.49 |
0 |
|
|
321966 |
126667556 |
1 |
FOSN3H14C21 |
ABCD3E14F21 |
58.43 |
7.61 |
-8.54 |
-1.2 |
0 |
|
|
321967 |
126667572 |
1 |
NO4C8H19 |
AB4C8D19 |
-196.23 |
3.48 |
-9.62 |
1.17 |
0 |
|
|
321968 |
126667576 |
1 |
N3H31C49 |
A3B31C49 |
248.16 |
0.46 |
-8.4 |
-1.18 |
0 |
|
|
321969 |
126667580 |
1 |
NH25C39 |
AB25C39 |
172.48 |
3.35 |
-8.41 |
-1.19 |
0 |
|
|
321970 |
126667587 |
1 |
NH43C54 |
AB43C54 |
216.41 |
0.56 |
-7.97 |
-0.46 |
0 |