List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
16999 |
481860 |
1 |
N6O9C45H56 |
A6B9C45D56 |
-334.78 |
5.41 |
-9.4 |
-0.32 |
0 |
|
|
17000 |
481873 |
1 |
N3O6C31H47 |
A3B6C31D47 |
-281.01 |
2.71 |
-9.33 |
0.2 |
0 |
|
|
17001 |
481878 |
4 |
NO2C10H14 |
AB2C10D14 |
-358.7 |
3.74 |
-9.42 |
-0.11 |
0 |
|
|
17002 |
481912 |
1 |
N4O9C34H52 |
A4B9C34D52 |
-385.92 |
3.31 |
-9.17 |
-0.22 |
0 |
|
|
17003 |
481913 |
1 |
N5O7C39H55 |
A5B7C39D55 |
-296.48 |
3.62 |
-8.48 |
0.01 |
0 |
|
|
17004 |
481964 |
1 |
O6N7C39H53 |
A6B7C39D53 |
-226.55 |
3.58 |
-9.12 |
-0.35 |
0 |
|
|
17005 |
481985 |
1 |
N5O8C40H57 |
A5B8C40D57 |
-342.65 |
4.13 |
-8.9 |
-0.33 |
0 |
|
|
17006 |
481993 |
1 |
N6O7C41H54 |
A6B7C41D54 |
-267.26 |
7.87 |
-8.88 |
-1.09 |
0 |
|
|
17007 |
482012 |
1 |
N4O8C37H50 |
A4B8C37D50 |
-324.65 |
7.74 |
-8.81 |
-0.78 |
0 |
|
|
17008 |
482022 |
1 |
N5O6C34H53 |
A5B6C34D53 |
-282.63 |
4.45 |
-9.1 |
-0.12 |
0 |
|
|
17009 |
482026 |
1 |
N3O7C37H51 |
A3B7C37D51 |
-303.56 |
5.16 |
-9.16 |
-0.21 |
0 |
|
|
17010 |
482071 |
1 |
O2N3C12H13 |
A2B3C12D13 |
-27.14 |
2.45 |
-9.42 |
-0.22 |
0 |
|
|
17011 |
482140 |
1 |
P3N13O17C29H38 |
A3B13C17D29E38 |
-783.71 |
10.42 |
-9.1 |
-0.63 |
0 |
|
|
17012 |
482149 |
1 |
PN7O8C23H30 |
AB7C8D23E30 |
-301.07 |
3.43 |
-9.62 |
-0.27 |
0 |
|
|
17013 |
482150 |
1 |
SN2O4C29H34 |
AB2C4D29E34 |
-84.65 |
5.33 |
-8.7 |
-0.46 |
0 |
|
|
17014 |
482192 |
1 |
N2O8H18C21 |
A2B8C18D21 |
-197.98 |
7.83 |
-8.6 |
-1.42 |
0 |
|
|
17015 |
482193 |
1 |
Cl2N2O6H8C13 |
A2B2C6D8E13 |
-158.53 |
3.8 |
-9.2 |
-1.89 |
0 |
|
|
17016 |
482194 |
1 |
BrNS2O5H16C17 |
ABC2D5E16F17 |
-162.23 |
8.71 |
-9.34 |
-1.86 |
0 |
|
|
17017 |
482245 |
1 |
FNOH10C14 |
ABCD10E14 |
-14.8 |
2.82 |
-8.96 |
-0.98 |
0 |
|
|
17018 |
482256 |
1 |
O2N6C11H14 |
A2B6C11D14 |
24.24 |
7.33 |
-10.58 |
-1.74 |
0 |
|
|
17019 |
482311 |
1 |
CoN4O6C24H28 |
AB4C6D24E28 |
28.49 |
7.09 |
0.0 |
0.0 |
0 |
|
|
17020 |
482360 |
2 |
FON3C11H11 |
ABC3D11E11 |
-71.08 |
5.9 |
-8.7 |
-0.62 |
0 |
|
|
17021 |
482362 |
1 |
SF2O4N8H20C21 |
AB2C4D8E20F21 |
-123.95 |
4.64 |
-9.65 |
-1.38 |
0 |
|
|
17022 |
482381 |
2 |
NOC9H9 |
ABC9D9 |
-39.5 |
1.7 |
-8.63 |
-0.11 |
0 |
|
|
17023 |
482387 |
1 |
O2N3C17H17 |
A2B3C17D17 |
-22.67 |
3.16 |
-9.67 |
-0.3 |
0 |
|
|
17024 |
482393 |
1 |
SO2N3C18H19 |
AB2C3D18E19 |
-18.91 |
3.63 |
-9.1 |
-0.35 |
0 |
|
|
17025 |
482397 |
1 |
N2O3C19H20 |
A2B3C19D20 |
-35.04 |
1.52 |
-9.42 |
-0.19 |
0 |
|
|
17026 |
482414 |
1 |
SN2O4H18C20 |
AB2C4D18E20 |
-81.56 |
4.98 |
-8.55 |
-1.78 |
0 |
|
|
17027 |
482420 |
1 |
BrSN2O2H13C17 |
ABC2D2E13F17 |
16.98 |
2.97 |
-8.64 |
-2.17 |
0 |
|
|
17028 |
482431 |
1 |
N3O13C47H55 |
A3B13C47D55 |
-453.45 |
9.35 |
-8.6 |
-1.52 |
0 |
|
|
17029 |
482479 |
1 |
N2F4O5C10H10 |
A2B4C5D10E10 |
-414.15 |
6.65 |
-10.66 |
-1.19 |
0 |
|
|
17030 |
482572 |
1 |
N4O7C30H36 |
A4B7C30D36 |
-261.9 |
2.03 |
-8.5 |
-1.23 |
0 |
|
|
17031 |
482614 |
1 |
SO4N7H13C18 |
AB4C7D13E18 |
128.44 |
4.0 |
-8.9 |
-3.12 |
0 |
|
|
17032 |
482628 |
1 |
BrSN3O3H24C26 |
ABC3D3E24F26 |
5.22 |
4.36 |
-7.94 |
-1.78 |
0 |
|
|
17033 |
482629 |
1 |
BrSN3O3H24C26 |
ABC3D3E24F26 |
5.31 |
4.62 |
-8.01 |
-1.7 |
0 |
|
|
17034 |
482661 |
1 |
SF2N2O4H10C15 |
AB2C2D4E10F15 |
-95.21 |
5.15 |
-9.0 |
-2.19 |
0 |
|
|
17035 |
482671 |
1 |
F2N3O4H23C24 |
A2B3C4D23E24 |
-179.31 |
10.38 |
-9.28 |
-1.5 |
0 |
|
|
17036 |
482674 |
1 |
F3N4O4H23C24 |
A3B4C4D23E24 |
-194.79 |
9.53 |
-9.19 |
-1.41 |
0 |
|
|
17037 |
482698 |
1 |
SO2H10C14 |
AB2C10D14 |
-3.32 |
4.9 |
-8.99 |
-1.04 |
0 |
|
|
17038 |
482722 |
1 |
O2C15H22 |
A2B15C22 |
-91.95 |
1.45 |
-8.98 |
0.1 |
0 |
|
|
17039 |
482734 |
1 |
NOSH11C12 |
ABCD11E12 |
19.66 |
4.24 |
-8.62 |
-0.47 |
0 |
|
|
17040 |
482741 |
1 |
SN2F3O6C30H31 |
AB2C3D6E30F31 |
-346.09 |
4.71 |
-8.86 |
-1.86 |
0 |
|
|
17041 |
482742 |
1 |
SN3O8C29H31 |
AB3C8D29E31 |
-185.89 |
4.11 |
-8.95 |
-2.39 |
0 |
|
|
17042 |
482747 |
2 |
N2S2Cl4O6H11C22 |
A2B2C4D6E11F22 |
-223.53 |
10.8 |
-8.67 |
-2.19 |
0 |
|
|
17043 |
482795 |
1 |
NSO6C32H33 |
ABC6D32E33 |
-148.2 |
6.01 |
-8.94 |
-0.74 |
0 |
|
|
17044 |
482807 |
1 |
O7H26C31 |
A7B26C31 |
-162.34 |
2.8 |
-8.41 |
-0.93 |
0 |
|
|
17045 |
482810 |
1 |
ClO7H27C32 |
AB7C27D32 |
-174.0 |
7.16 |
-8.75 |
-1.09 |
0 |
|
|
17046 |
482830 |
1 |
BrN2O3H17C18 |
AB2C3D17E18 |
-60.43 |
4.23 |
-8.56 |
-0.63 |
0 |
|
|
17047 |
482860 |
1 |
O6N15C36H49 |
A6B15C36D49 |
-143.24 |
9.19 |
-8.43 |
-0.19 |
0 |
|
|
17048 |
482877 |
1 |
ClFSN3H13C14 |
ABCD3E13F14 |
16.22 |
3.08 |
-9.14 |
-0.72 |
0 |