List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
221530 |
85278717 |
1 |
NO9C40H77 |
AB9C40D77 |
-544.18 |
6.77 |
-9.78 |
0.46 |
0 |
|
|
221531 |
85278802 |
1 |
Si3O8C38H72 |
A3B8C38D72 |
-505.94 |
0.83 |
-9.13 |
0.14 |
0 |
|
|
221532 |
85278817 |
1 |
O7H46C49 |
A7B46C49 |
-148.79 |
2.09 |
-9.27 |
0.06 |
0 |
|
|
221533 |
85278850 |
2 |
NO8C18H20 |
AB8C18D20 |
-610.28 |
5.25 |
-9.56 |
-0.72 |
0 |
|
|
221534 |
85279013 |
1 |
ISi2O5C40H81 |
AB2C5D40E81 |
-400.98 |
3.57 |
-8.89 |
-0.61 |
0 |
|
|
221535 |
85279100 |
1 |
PN7O7C47H52 |
AB7C7D47E52 |
-143.28 |
5.2 |
-8.24 |
-1.21 |
0 |
|
|
221536 |
85279102 |
1 |
Cl2N3O15H37C39 |
A2B3C15D37E39 |
-461.64 |
8.8 |
-9.15 |
-0.87 |
0 |
|
|
221537 |
85279106 |
1 |
NO6C56H79 |
AB6C56D79 |
-279.91 |
4.08 |
-8.71 |
-0.01 |
0 |
|
|
221538 |
85279126 |
2 |
O6C25H39 |
A6B25C39 |
-607.58 |
5.6 |
-8.5 |
0.28 |
0 |
|
|
221539 |
85279272 |
2 |
SiO5C27H46 |
AB5C27D46 |
-614.86 |
5.66 |
-8.61 |
0.17 |
0 |
|
|
221540 |
85279285 |
1 |
N9O11C49H75 |
A9B11C49D75 |
-541.31 |
12.51 |
-9.18 |
-0.29 |
0 |
|
|
221541 |
85279314 |
1 |
NS2O18C42H47 |
AB2C18D42E47 |
-652.5 |
9.09 |
-9.33 |
-1.31 |
0 |
|
|
221542 |
85279333 |
1 |
SN8O8C54H84 |
AB8C8D54E84 |
-347.97 |
10.65 |
-8.16 |
-0.08 |
0 |
|
|
221543 |
85279369 |
1 |
ClNO23C48H50 |
ABC23D48E50 |
-913.69 |
8.75 |
-8.87 |
-1.87 |
0 |
|
|
221544 |
85279410 |
1 |
SiCl3O13C56H71 |
AB3C13D56E71 |
-549.86 |
3.17 |
-8.8 |
-0.63 |
0 |
|
|
221545 |
85279433 |
3 |
H3C10F13 |
A3B10C13 |
-1880.53 |
2.09 |
-10.31 |
-1.43 |
0 |
|
|
221546 |
85279483 |
1 |
N10O15C57H90 |
A10B15C57D90 |
-729.7 |
7.53 |
-9.37 |
-0.29 |
0 |
|
|
221547 |
85279485 |
3 |
O9C18H26 |
A9B18C26 |
-1164.49 |
9.89 |
-10.07 |
-0.45 |
0 |
|
|
221548 |
85279499 |
1 |
S2Si2O13C62H104 |
A2B2C13D62E104 |
-701.78 |
3.47 |
-8.46 |
-0.65 |
0 |
|
|
221549 |
85279500 |
1 |
N15O17C51H83 |
A15B17C51D83 |
-820.28 |
13.79 |
-9.23 |
-0.18 |
0 |
|
|
221550 |
85279576 |
1 |
O14N21C60H115 |
A14B21C60D115 |
-764.6 |
14.52 |
-9.32 |
0.06 |
0 |
|
|
221551 |
85279604 |
1 |
PN4O16C78H129 |
AB4C16D78E129 |
-821.49 |
3.7 |
-9.48 |
-0.35 |
0 |
|
|
221552 |
85279607 |
1 |
NSiO19C82H91 |
ABC19D82E91 |
-639.14 |
5.48 |
-9.01 |
-0.48 |
0 |
|
|
221553 |
85279624 |
1 |
SO19C89H98 |
AB19C89D98 |
-623.55 |
3.14 |
-8.57 |
-0.79 |
0 |
|
|
221554 |
85279629 |
1 |
N21O22C64H109 |
A21B22C64D109 |
-978.38 |
15.11 |
-9.53 |
-1.62 |
0 |
|
|
221555 |
85279649 |
1 |
PN3Si7O17C86H176 |
AB3C7D17E86F176 |
-1165.53 |
5.01 |
-8.13 |
-0.53 |
0 |
|
|
221556 |
85279650 |
1 |
ClN12O25C87H117 |
AB12C25D87E117 |
-897.49 |
18.83 |
-7.54 |
-1.87 |
0 |
|
|
221557 |
85279658 |
1 |
O42C87H134 |
A42B87C134 |
-1885.33 |
6.93 |
-8.52 |
-1.02 |
0 |
|
|
221558 |
85279662 |
1 |
S5O46C76H102 |
A5B46C76D102 |
-2102.62 |
6.25 |
-8.72 |
-0.34 |
0 |
|
|
221559 |
85279691 |
2 |
C5H8 |
A5B8 |
19.96 |
0.46 |
-8.91 |
0.5 |
0 |
|
|
221560 |
85279746 |
1 |
NOC10H15 |
ABC10D15 |
-26.02 |
4.96 |
-9.8 |
0.22 |
0 |
|
|
221561 |
85279747 |
1 |
NOC10H15 |
ABC10D15 |
-49.18 |
4.82 |
-9.8 |
1.19 |
0 |
|
|
221562 |
85279763 |
1 |
ON2C9H16 |
AB2C9D16 |
27.35 |
2.18 |
-9.12 |
0.7 |
0 |
|
|
221563 |
85279789 |
2 |
O2C4H7 |
A2B4C7 |
-184.36 |
2.76 |
-10.05 |
1.03 |
0 |
|
|
221564 |
85279793 |
1 |
N2C11H16 |
A2B11C16 |
55.68 |
4.21 |
-9.06 |
0.48 |
0 |
|
|
221565 |
85279828 |
1 |
ClOC10H11 |
ABC10D11 |
-28.9 |
2.97 |
-9.63 |
-0.26 |
0 |
|
|
221566 |
85279891 |
2 |
ON2C4H5 |
AB2C4D5 |
-1.99 |
1.09 |
-10.23 |
-0.94 |
0 |
|
|
221567 |
85279905 |
1 |
OC13H22 |
AB13C22 |
-59.84 |
1.54 |
-9.21 |
1.41 |
0 |
|
|
221568 |
85279907 |
1 |
NO3C10H13 |
AB3C10D13 |
-124.39 |
3.48 |
-9.57 |
0.29 |
0 |
|
|
221569 |
85279945 |
1 |
ON2H10C12 |
AB2C10D12 |
110.69 |
2.24 |
-10.38 |
-1.77 |
0 |
|
|
221570 |
85279985 |
1 |
NOC13H15 |
ABC13D15 |
24.59 |
6.68 |
-8.84 |
-0.13 |
0 |
|
|
221571 |
85279990 |
1 |
O2C13H14 |
A2B13C14 |
15.89 |
3.2 |
-8.75 |
-0.05 |
0 |
|
|
221572 |
85279998 |
1 |
NOSH9C11 |
ABCD9E11 |
26.05 |
2.94 |
-9.22 |
-1.27 |
0 |
|
|
221573 |
85280011 |
1 |
O2C13H16 |
A2B13C16 |
-26.22 |
4.55 |
-9.98 |
-0.2 |
0 |
|
|
221574 |
85280028 |
1 |
NC14H23 |
AB14C23 |
-6.85 |
2.33 |
-9.1 |
1.14 |
0 |
|
|
221575 |
85280046 |
1 |
NO3C11H13 |
AB3C11D13 |
-18.06 |
4.02 |
-9.01 |
0.0 |
0 |
|
|
221576 |
85280047 |
1 |
O2N3C10H13 |
A2B3C10D13 |
9.68 |
6.76 |
-8.78 |
-0.95 |
0 |
|
|
221577 |
85280054 |
1 |
NOC10H21 |
ABC10D21 |
-84.54 |
3.39 |
-9.14 |
2.8 |
0 |
|
|
221578 |
85280126 |
1 |
NO4C10H17 |
AB4C10D17 |
-190.0 |
6.8 |
-9.94 |
0.17 |
0 |
|
|
221579 |
85280520 |
2 |
OC8H10 |
AB8C10 |
-78.9 |
5.73 |
-9.32 |
-0.16 |
0 |