List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
267300 |
103581698 |
1 |
BrClNOSC12H17 |
ABCDEF12G17 |
-34.54 |
4.09 |
-8.8 |
-0.46 |
0 |
|
|
267301 |
103581700 |
1 |
BrClN3C11H11 |
ABC3D11E11 |
62.13 |
4.79 |
-9.68 |
-0.64 |
0 |
|
|
267302 |
103581701 |
1 |
BrClNOC12H17 |
ABCDE12F17 |
-48.55 |
4.98 |
-9.23 |
-0.32 |
0 |
|
|
267303 |
103581702 |
1 |
BrClNC11H13 |
ABCD11E13 |
20.23 |
4.04 |
-9.3 |
-0.42 |
0 |
|
|
267304 |
103581707 |
1 |
OSN2C10H20 |
ABC2D10E20 |
-70.31 |
3.9 |
-8.62 |
0.66 |
0 |
|
|
267305 |
103581708 |
1 |
ON2C12H22 |
AB2C12D22 |
-64.93 |
3.91 |
-9.25 |
1.33 |
0 |
|
|
267306 |
103581709 |
1 |
FON2C14H21 |
ABC2D14E21 |
-96.33 |
4.11 |
-9.41 |
-0.1 |
0 |
|
|
267307 |
103581712 |
1 |
BrClSN2O2C12H18 |
ABCD2E2F12G18 |
-80.54 |
4.2 |
-9.01 |
-0.32 |
0 |
|
|
267308 |
103581717 |
1 |
BrClN3C14H21 |
ABC3D14E21 |
18.35 |
3.59 |
-8.46 |
-0.35 |
0 |
|
|
267309 |
103581718 |
1 |
BrClN2O2C14H18 |
ABC2D2E14F18 |
-69.26 |
3.93 |
-9.34 |
-0.66 |
0 |
|
|
267310 |
103581721 |
1 |
BrClNOC13H19 |
ABCDE13F19 |
-53.47 |
4.6 |
-9.22 |
-0.33 |
0 |
|
|
267311 |
103581734 |
1 |
BrClNOSC11H15 |
ABCDEF11G15 |
-14.06 |
6.28 |
-8.53 |
-0.44 |
0 |
|
|
267312 |
103581735 |
1 |
BrClNC12H15 |
ABCD12E15 |
23.5 |
3.89 |
-9.3 |
-0.43 |
0 |
|
|
267313 |
103581738 |
1 |
BrClNC11H13 |
ABCD11E13 |
29.63 |
3.55 |
-9.32 |
-0.43 |
0 |
|
|
267314 |
103581746 |
1 |
BrClNOC11H15 |
ABCDE11F15 |
-39.27 |
2.64 |
-9.45 |
-0.5 |
0 |
|
|
267315 |
103581759 |
1 |
BrClSN2C12H12 |
ABCD2E12F12 |
47.6 |
2.79 |
-9.48 |
-0.54 |
0 |
|
|
267316 |
103581765 |
1 |
BrClNSC11H13 |
ABCDE11F13 |
13.63 |
3.35 |
-8.69 |
-0.47 |
0 |
|
|
267317 |
103581767 |
1 |
BrClSN2C13H14 |
ABCD2E13F14 |
41.29 |
5.08 |
-9.44 |
-0.69 |
0 |
|
|
267318 |
103581769 |
1 |
BrClNF3C10H10 |
ABCD3E10F10 |
-150.55 |
0.41 |
-9.67 |
-0.62 |
0 |
|
|
267319 |
103581781 |
1 |
BrClNOC14H19 |
ABCDE14F19 |
-40.43 |
2.61 |
-9.36 |
-0.48 |
0 |
|
|
267320 |
103581783 |
1 |
O2N3C11H21 |
A2B3C11D21 |
-48.9 |
3.74 |
-9.28 |
-0.37 |
0 |
|
|
267321 |
103581800 |
1 |
BrClNC12H13 |
ABCD12E13 |
29.46 |
2.56 |
-9.31 |
-0.5 |
0 |
|
|
267322 |
103581812 |
1 |
BrClSN2O2C14H14 |
ABCD2E2F14G14 |
-36.61 |
3.86 |
-8.6 |
-0.7 |
0 |
|
|
267323 |
103581813 |
1 |
BrClON3H13C14 |
ABCD3E13F14 |
-3.13 |
4.84 |
-8.49 |
-0.57 |
0 |
|
|
267324 |
103581814 |
1 |
BrClSN2O2C14H14 |
ABCD2E2F14G14 |
-43.37 |
3.89 |
-8.52 |
-0.74 |
0 |
|
|
267325 |
103581817 |
1 |
BrClON2C16H16 |
ABCD2E16F16 |
-7.67 |
6.03 |
-8.41 |
-0.31 |
0 |
|
|
267326 |
103581836 |
1 |
BrClNC11H11 |
ABCD11E11 |
62.74 |
3.93 |
-9.44 |
-0.36 |
0 |
|
|
267327 |
103581837 |
1 |
BrClNOC12H17 |
ABCDE12F17 |
-50.51 |
3.28 |
-9.38 |
-0.48 |
0 |
|
|
267328 |
103581843 |
1 |
BrClN3C13H15 |
ABC3D13E15 |
50.85 |
1.55 |
-8.3 |
-0.51 |
0 |
|
|
267329 |
103581844 |
1 |
BrClNOC13H19 |
ABCDE13F19 |
-47.49 |
3.2 |
-9.42 |
-0.43 |
0 |
|
|
267330 |
103581850 |
1 |
BrClNOC12H17 |
ABCDE12F17 |
-49.64 |
2.67 |
-9.25 |
-0.42 |
0 |
|
|
267331 |
103581854 |
1 |
BrClNOC13H17 |
ABCDE13F17 |
-33.12 |
4.01 |
-9.46 |
-0.44 |
0 |
|
|
267332 |
103581857 |
1 |
BrClSN2H10C11 |
ABCD2E10F11 |
60.05 |
2.89 |
-9.6 |
-0.79 |
0 |
|
|
267333 |
103581862 |
1 |
BrClNOF2C10H11 |
ABCDE2F10G11 |
-133.12 |
3.93 |
-9.69 |
-0.64 |
0 |
|
|
267334 |
103581866 |
1 |
N2O2C11H24 |
A2B2C11D24 |
-98.87 |
4.86 |
-9.05 |
1.78 |
0 |
|
|
267335 |
103581876 |
1 |
N2O3C17H32 |
A2B3C17D32 |
-188.79 |
3.68 |
-8.95 |
0.69 |
0 |
|
|
267336 |
103581877 |
1 |
N2O3C16H32 |
A2B3C16D32 |
-185.14 |
1.54 |
-8.7 |
0.95 |
0 |
|
|
267337 |
103581881 |
1 |
BrON3C15H20 |
ABC3D15E20 |
0.92 |
4.09 |
-8.08 |
0.43 |
0 |
|
|
267338 |
103581894 |
1 |
BrNO2C16H18 |
ABC2D16E18 |
-53.7 |
1.3 |
-8.57 |
-0.12 |
0 |
|
|
267339 |
103581895 |
1 |
BrN3C16H18 |
AB3C16D18 |
49.9 |
4.93 |
-8.28 |
-0.13 |
0 |
|
|
267340 |
103581900 |
1 |
BrNOC14H20 |
ABCD14E20 |
-58.8 |
1.39 |
-8.38 |
0.35 |
0 |
|
|
267341 |
103581916 |
1 |
BrON2H13C14 |
ABC2D13E14 |
33.76 |
2.26 |
-8.67 |
-0.9 |
0 |
|
|
267342 |
103581917 |
1 |
BrN2C13H15 |
AB2C13D15 |
28.58 |
5.03 |
-8.12 |
0.54 |
0 |
|
|
267343 |
103581927 |
1 |
ClNOH10C11 |
ABCD10E11 |
18.83 |
4.45 |
-9.8 |
-0.52 |
0 |
|
|
267344 |
103581929 |
1 |
ClNO3C14H18 |
ABC3D14E18 |
-143.56 |
5.57 |
-9.77 |
-0.51 |
0 |
|
|
267345 |
103581930 |
1 |
ClNOH12C16 |
ABCD12E16 |
43.01 |
4.89 |
-8.88 |
-0.69 |
0 |
|
|
267346 |
103581932 |
1 |
ClON2H13C16 |
ABC2D13E16 |
18.66 |
3.36 |
-9.82 |
-0.84 |
0 |
|
|
267347 |
103581933 |
1 |
ClON2H13C16 |
ABC2D13E16 |
18.62 |
4.71 |
-9.86 |
-0.9 |
0 |
|
|
267348 |
103581934 |
1 |
ClN2O2H13C16 |
AB2C2D13E16 |
-14.87 |
7.89 |
-8.95 |
-0.83 |
0 |
|
|
267349 |
103581943 |
1 |
SO2N4C7H10 |
AB2C4D7E10 |
-28.08 |
6.93 |
-9.75 |
-1.03 |
0 |