List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
200595 |
79415345 |
3 |
NOC5H5 |
ABC5D5 |
-54.64 |
3.81 |
-8.7 |
-0.61 |
0 |
|
|
200596 |
79415346 |
1 |
NO3C8H13 |
AB3C8D13 |
-119.2 |
4.3 |
-10.98 |
0.08 |
0 |
|
|
200597 |
79415347 |
1 |
NO3C7H11 |
AB3C7D11 |
-119.02 |
5.23 |
-11.03 |
0.04 |
0 |
|
|
200598 |
79415348 |
1 |
NOC15H27 |
ABC15D27 |
-80.67 |
3.29 |
-9.57 |
3.12 |
0 |
|
|
200599 |
79415349 |
1 |
ON2C12H26 |
AB2C12D26 |
-83.1 |
1.69 |
-8.73 |
2.53 |
0 |
|
|
200600 |
79415350 |
1 |
ON2C13H28 |
AB2C13D28 |
-86.91 |
2.54 |
-8.56 |
2.71 |
0 |
|
|
200601 |
79415351 |
1 |
BrNO2C13H20 |
ABC2D13E20 |
-80.55 |
4.39 |
-9.11 |
-0.3 |
0 |
|
|
200602 |
79415352 |
1 |
NO2C14H23 |
AB2C14D23 |
-90.24 |
1.84 |
-8.83 |
0.18 |
0 |
|
|
200603 |
79415353 |
1 |
NO2F3C13H18 |
AB2C3D13E18 |
-246.3 |
2.04 |
-9.32 |
-0.49 |
0 |
|
|
200604 |
79415354 |
1 |
NO2C13H27 |
AB2C13D27 |
-137.2 |
1.96 |
-9.44 |
2.21 |
0 |
|
|
200605 |
79415355 |
1 |
NO2C12H25 |
AB2C12D25 |
-137.52 |
4.41 |
-9.68 |
2.43 |
0 |
|
|
200606 |
79415356 |
1 |
NOC14H29 |
ABC14D29 |
-99.67 |
2.87 |
-9.45 |
3.12 |
0 |
|
|
200607 |
79415357 |
1 |
NOC14H29 |
ABC14D29 |
-102.16 |
2.73 |
-9.42 |
3.08 |
0 |
|
|
200608 |
79415358 |
1 |
ON2C16H22 |
AB2C16D22 |
-26.38 |
2.72 |
-9.09 |
-0.55 |
0 |
|
|
200609 |
79415359 |
1 |
N2O3C10H16 |
A2B3C10D16 |
-106.17 |
4.9 |
-9.14 |
0.01 |
0 |
|
|
200610 |
79415360 |
1 |
N2O2C11H18 |
A2B2C11D18 |
-82.57 |
5.12 |
-9.09 |
0.06 |
0 |
|
|
200611 |
79415361 |
1 |
N2O3C15H18 |
A2B3C15D18 |
-82.08 |
4.76 |
-8.36 |
-0.1 |
0 |
|
|
200612 |
79415362 |
1 |
Cl2N2O2H12C13 |
A2B2C2D12E13 |
-57.96 |
3.13 |
-9.13 |
-0.52 |
0 |
|
|
200613 |
79415363 |
1 |
N2O2C15H18 |
A2B2C15D18 |
-54.91 |
3.89 |
-8.39 |
-0.22 |
0 |
|
|
200614 |
79415364 |
1 |
SN2O2C13H16 |
AB2C2D13E16 |
-35.83 |
1.43 |
-9.16 |
-0.21 |
0 |
|
|
200615 |
79415365 |
1 |
N2O3C12H20 |
A2B3C12D20 |
-117.0 |
3.78 |
-9.14 |
0.01 |
0 |
|
|
200616 |
79415366 |
1 |
ClN2O2C15H17 |
AB2C2D15E17 |
-53.08 |
1.85 |
-9.32 |
-0.19 |
0 |
|
|
200617 |
79415367 |
1 |
O2N3C14H23 |
A2B3C14D23 |
-71.02 |
3.56 |
-8.67 |
0.04 |
0 |
|
|
200618 |
79415368 |
1 |
N2O3C14H24 |
A2B3C14D24 |
-127.92 |
6.12 |
-9.17 |
0.0 |
0 |
|
|
200619 |
79415791 |
1 |
O3N4C11H14 |
A3B4C11D14 |
-39.73 |
3.11 |
-9.42 |
-0.55 |
0 |
|
|
200620 |
79415886 |
1 |
N2O2C15H24 |
A2B2C15D24 |
-91.52 |
4.68 |
-9.22 |
-0.06 |
0 |
|
|
200621 |
79415987 |
1 |
NBr2O2C13H15 |
AB2C2D13E15 |
-33.88 |
1.3 |
-8.84 |
-0.86 |
0 |
|
|
200622 |
79416308 |
1 |
NSBr2O4H9C12 |
ABC2D4E9F12 |
-85.47 |
5.56 |
-8.93 |
-1.65 |
0 |
|
|
200623 |
79416695 |
1 |
O2C15H26 |
A2B15C26 |
-132.66 |
5.27 |
-9.52 |
0.72 |
0 |
|
|
200624 |
79416946 |
1 |
NOSC14H17 |
ABCD14E17 |
-16.6 |
3.71 |
-9.31 |
-0.29 |
0 |
|
|
200625 |
79416987 |
1 |
O2C15H22 |
A2B15C22 |
-91.55 |
3.19 |
-8.59 |
0.32 |
0 |
|
|
200626 |
79416988 |
1 |
NOC13H19 |
ABC13D19 |
-41.19 |
4.73 |
-9.7 |
-0.02 |
0 |
|
|
200627 |
79416989 |
1 |
ON2C16H20 |
AB2C16D20 |
4.27 |
3.88 |
-8.84 |
-0.38 |
0 |
|
|
200628 |
79416990 |
1 |
O3C10H20 |
A3B10C20 |
-162.7 |
3.25 |
-9.72 |
0.56 |
0 |
|
|
200629 |
79417087 |
1 |
N2O3C15H16 |
A2B3C15D16 |
-96.88 |
3.26 |
-9.0 |
-0.81 |
0 |
|
|
200630 |
79417824 |
1 |
OSN2C16H22 |
ABC2D16E22 |
3.51 |
1.58 |
-8.88 |
-0.42 |
0 |
|
|
200631 |
79418160 |
1 |
O3C14H18 |
A3B14C18 |
-123.47 |
4.71 |
-9.44 |
0.07 |
0 |
|
|
200632 |
79418299 |
1 |
FO3C11H13 |
AB3C11D13 |
-169.07 |
3.08 |
-9.83 |
-0.35 |
0 |
|
|
200633 |
79418530 |
1 |
BrOC15H21 |
ABC15D21 |
-52.49 |
3.7 |
-9.2 |
0.05 |
0 |
|
|
200634 |
79418721 |
1 |
NO2C17H19 |
AB2C17D19 |
-56.75 |
4.07 |
-9.41 |
-0.2 |
0 |
|
|
200635 |
79418771 |
1 |
BrC17H19 |
AB17C19 |
16.92 |
2.47 |
-9.05 |
0.07 |
0 |
|
|
200636 |
79418853 |
2 |
OH8C9 |
AB8C9 |
-8.46 |
4.18 |
-9.27 |
-0.19 |
0 |
|
|
200637 |
79419554 |
1 |
ClSN3H12C14 |
ABC3D12E14 |
86.25 |
3.98 |
-8.59 |
-0.83 |
0 |
|
|
200638 |
79419579 |
1 |
ClN3O3C13H14 |
AB3C3D13E14 |
-94.46 |
6.6 |
-9.31 |
-1.01 |
0 |
|
|
200639 |
79419742 |
1 |
ClNS2C11H12 |
ABC2D11E12 |
45.85 |
2.54 |
-8.98 |
-0.51 |
0 |
|
|
200640 |
79419887 |
1 |
ClOSN2C13H13 |
ABCD2E13F13 |
-5.67 |
3.64 |
-8.98 |
-0.74 |
0 |
|
|
200641 |
79420044 |
1 |
ClFNSC13H13 |
ABCDE13F13 |
-9.33 |
1.11 |
-9.2 |
-0.55 |
0 |
|
|
200642 |
79420629 |
1 |
N2O3C12H24 |
A2B3C12D24 |
-157.12 |
4.12 |
-8.92 |
1.25 |
0 |
|
|
200643 |
79420721 |
1 |
NO3C12H13 |
AB3C12D13 |
-83.81 |
2.34 |
-9.12 |
-0.3 |
0 |
|
|
200644 |
79420972 |
1 |
BrIO2H8C9 |
ABC2D8E9 |
-49.28 |
2.32 |
-9.63 |
-1.25 |
0 |