List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
319656 |
126656935 |
1 |
N3C13H29 |
A3B13C29 |
-6.54 |
1.91 |
-8.79 |
1.09 |
0 |
|
|
319657 |
126656936 |
1 |
ON4C22H26 |
AB4C22D26 |
59.61 |
3.35 |
-8.95 |
-0.19 |
0 |
|
|
319658 |
126656943 |
1 |
IPO2H16C20 |
ABC2D16E20 |
1.47 |
1.38 |
-8.8 |
-1.11 |
0 |
|
|
319659 |
126656946 |
2 |
NH26C41 |
AB26C41 |
356.08 |
2.57 |
-8.14 |
-1.1 |
0 |
|
|
319660 |
126656948 |
1 |
NSO2C17H19 |
ABC2D17E19 |
3.73 |
3.69 |
-9.0 |
-0.11 |
0 |
|
|
319663 |
126656954 |
1 |
ION3C5H14 |
ABC3D5E14 |
-17.66 |
1.73 |
-8.81 |
-1.7 |
0 |
|
|
319664 |
126656959 |
1 |
I2C5H8 |
A2B5C8 |
31.29 |
2.4 |
-9.29 |
-0.95 |
0 |
|
|
319665 |
126656960 |
1 |
NC19H25 |
AB19C25 |
7.89 |
2.48 |
-7.94 |
-0.15 |
0 |
|
|
319666 |
126656962 |
1 |
NC13H23 |
AB13C23 |
3.4 |
1.26 |
-8.57 |
1.4 |
0 |
|
|
319667 |
126656966 |
1 |
IPSN8O9C23H36 |
ABCD8E9F23G36 |
-297.63 |
4.02 |
-8.76 |
-1.76 |
0 |
|
|
319668 |
126656972 |
1 |
N8O10C35H52 |
A8B10C35D52 |
-395.54 |
4.45 |
-8.62 |
-0.26 |
0 |
|
|
319669 |
126656974 |
1 |
NO2C13H19 |
AB2C13D19 |
-85.24 |
2.93 |
-9.43 |
0.1 |
0 |
|
|
319671 |
126656984 |
1 |
N6O8C31H40 |
A6B8C31D40 |
-269.14 |
5.4 |
-8.97 |
-0.2 |
0 |
|
|
319672 |
126656986 |
1 |
N6O9C44H60 |
A6B9C44D60 |
-310.79 |
2.58 |
-8.51 |
-0.48 |
0 |
|
|
319674 |
126656995 |
1 |
F5H13C20 |
A5B13C20 |
-184.14 |
1.64 |
-9.52 |
-0.94 |
0 |
|
|
319675 |
126656996 |
1 |
N3C17H35 |
A3B17C35 |
-30.37 |
2.81 |
-8.52 |
1.34 |
0 |
|
|
319678 |
126657000 |
1 |
N7O8C32H47 |
A7B8C32D47 |
-237.81 |
5.33 |
-8.25 |
-0.29 |
0 |
|
|
319679 |
126657001 |
1 |
NC11H19 |
AB11C19 |
7.62 |
1.26 |
-8.13 |
0.73 |
0 |
|
|
319680 |
126657005 |
1 |
SN5O5C24H35 |
AB5C5D24E35 |
-181.18 |
6.02 |
-9.29 |
-0.96 |
0 |
|
|
319683 |
126657010 |
1 |
O5N7C27H41 |
A5B7C27D41 |
-156.74 |
6.71 |
-8.95 |
-0.27 |
0 |
|
|
319687 |
126657017 |
1 |
SN2O4C22H32 |
AB2C4D22E32 |
-97.86 |
4.78 |
-8.31 |
-0.84 |
0 |
|
|
319690 |
126657023 |
1 |
NOC9H21 |
ABC9D21 |
-88.86 |
1.88 |
-9.24 |
2.34 |
0 |
|
|
319692 |
126657027 |
1 |
SN3O7C42H47 |
AB3C7D42E47 |
-168.51 |
1.5 |
-8.67 |
-0.8 |
0 |
|
|
319694 |
126657029 |
2 |
OPH20C23 |
ABC20D23 |
42.88 |
9.04 |
-9.0 |
-0.12 |
0 |
|
|
319697 |
126657032 |
1 |
NO12C25H41 |
AB12C25D41 |
-397.46 |
5.24 |
-9.5 |
0.52 |
0 |
|
|
319698 |
126657035 |
1 |
NO3C21H41 |
AB3C21D41 |
-188.33 |
4.97 |
-9.99 |
1.04 |
0 |
|
|
319699 |
126657038 |
1 |
N4O8C17H40 |
A4B8C17D40 |
-370.33 |
1.83 |
-9.52 |
0.9 |
0 |
|
|
319700 |
126657041 |
1 |
OS2C23H46 |
AB2C23D46 |
-129.25 |
4.43 |
-8.49 |
0.25 |
0 |
|
|
319702 |
126657048 |
1 |
NOSH27C42 |
ABCD27E42 |
312.07 |
2.69 |
-7.74 |
-0.99 |
0 |
|
|
319703 |
126657049 |
1 |
O2F3S3C11H17 |
A2B3C3D11E17 |
-245.99 |
3.47 |
-8.93 |
-1.31 |
0 |
|
|
319704 |
126657050 |
1 |
OS2C19H38 |
AB2C19D38 |
-105.73 |
0.79 |
-8.59 |
0.22 |
0 |
|
|
319705 |
126657051 |
1 |
NO2S3F9C33H52 |
AB2C3D9E33F52 |
-587.82 |
1.47 |
-8.76 |
-1.34 |
0 |
|
|
319706 |
126657052 |
1 |
OS2C25H50 |
AB2C25D50 |
-130.5 |
3.89 |
-8.64 |
0.35 |
0 |
|
|
319707 |
126657053 |
1 |
OS2C27H54 |
AB2C27D54 |
-139.1 |
3.92 |
-8.64 |
0.35 |
0 |
|
|
319709 |
126657055 |
6 |
O4C9H14 |
A4B9C14 |
-1124.45 |
6.66 |
-9.45 |
-0.38 |
0 |
|
|
319712 |
126657060 |
1 |
S3N4C20H52 |
A3B4C20D52 |
36.42 |
1.28 |
-5.91 |
1.35 |
0 |
|
|
319713 |
126657061 |
1 |
S3N4C10H30 |
A3B4C10D30 |
48.04 |
1.55 |
-6.36 |
1.0 |
0 |
|
|
319714 |
126657063 |
1 |
S3N4C10H26 |
A3B4C10D26 |
10.89 |
3.56 |
-7.55 |
-0.39 |
0 |
|
|
319717 |
126657087 |
6 |
NOC5H7 |
ABC5D7 |
-232.57 |
1.53 |
-8.33 |
-0.54 |
0 |
|
|
319718 |
126657088 |
1 |
FPN3O9C22H29 |
ABC3D9E22F29 |
-481.94 |
4.59 |
-9.46 |
-0.74 |
0 |
|
|
319719 |
126657089 |
2 |
SN3O5C15H22 |
AB3C5D15E22 |
-380.39 |
9.63 |
-9.22 |
-1.29 |
0 |
|
|
319723 |
126657118 |
1 |
NSO6H25C27 |
ABC6D25E27 |
-176.21 |
13.49 |
-9.07 |
-1.76 |
0 |
|
|
319724 |
126657119 |
1 |
NSO6H25C27 |
ABC6D25E27 |
-182.46 |
15.9 |
-9.07 |
-1.74 |
0 |
|
|
319725 |
126657122 |
1 |
N9O22C57H89 |
A9B22C57D89 |
-877.07 |
17.16 |
-8.39 |
-0.79 |
0 |
|
|
319727 |
126657125 |
1 |
O2N5C14H19 |
A2B5C14D19 |
-44.44 |
6.67 |
-9.02 |
-0.53 |
0 |
|
|
319729 |
126657127 |
1 |
SO3N5C15H17 |
AB3C5D15E17 |
-69.45 |
1.45 |
-9.59 |
-1.24 |
0 |
|
|
319730 |
126657130 |
1 |
N3O3C28H33 |
A3B3C28D33 |
-74.21 |
4.75 |
-8.21 |
-0.32 |
0 |
|
|
319732 |
126657135 |
1 |
FSN2O2C23H23 |
ABC2D2E23F23 |
-76.86 |
3.6 |
-8.65 |
-0.54 |
0 |
|
|
319733 |
126657136 |
1 |
INSH8C9 |
ABCD8E9 |
84.23 |
6.74 |
-8.53 |
-2.27 |
0 |
|
|
319734 |
126657137 |
1 |
O3N4C24H24 |
A3B4C24D24 |
-28.12 |
8.68 |
-8.52 |
-0.66 |
0 |
|
|
319735 |
126657138 |
2 |
NO2C12H13 |
AB2C12D13 |
-97.92 |
4.98 |
-8.47 |
-0.16 |
0 |
|
|
319736 |
126657140 |
1 |
O3N4C23H26 |
A3B4C23D26 |
-30.03 |
3.25 |
-8.65 |
-0.38 |
0 |
|
|
319737 |
126657143 |
1 |
N3O3C23H25 |
A3B3C23D25 |
-59.08 |
7.28 |
-8.46 |
-0.28 |
0 |
|
|
319738 |
126657144 |
1 |
SN2O3C20H20 |
AB2C3D20E20 |
-57.81 |
2.32 |
-8.87 |
-0.6 |
0 |
|
|
319739 |
126657145 |
1 |
O3N4C23H26 |
A3B4C23D26 |
-31.72 |
3.82 |
-8.7 |
-0.4 |
0 |
|
|
319741 |
126657150 |
1 |
N3O3C23H23 |
A3B3C23D23 |
-43.37 |
4.98 |
-8.42 |
-0.87 |
0 |
|
|
319743 |
126657153 |
1 |
O2N3C23H31 |
A2B3C23D31 |
-21.33 |
5.29 |
-7.76 |
-0.13 |
0 |
|
|
319744 |
126657154 |
1 |
NC13H23 |
AB13C23 |
-16.52 |
1.37 |
-8.47 |
1.41 |
0 |
|
|
319745 |
126657157 |
1 |
N3C10H19 |
A3B10C19 |
16.8 |
4.72 |
-9.59 |
0.44 |
0 |
|
|
319746 |
126657166 |
1 |
N2C9H18 |
A2B9C18 |
-2.15 |
0.99 |
-8.14 |
0.54 |
0 |
|
|
319749 |
126657170 |
1 |
OC24H38 |
AB24C38 |
-48.3 |
1.82 |
-8.21 |
0.02 |
0 |
|
|
319750 |
126657174 |
1 |
O2N3C26H27 |
A2B3C26D27 |
-1.03 |
3.64 |
-8.29 |
-0.85 |
0 |
|
|
319752 |
126657181 |
1 |
N2O3C25H26 |
A2B3C25D26 |
-38.51 |
1.81 |
-8.82 |
-0.42 |
0 |
|
|
319753 |
126657187 |
1 |
O3N4C32H36 |
A3B4C32D36 |
-30.09 |
6.05 |
-8.88 |
-0.46 |
0 |
|
|
319754 |
126657188 |
1 |
SO2N6C23H26 |
AB2C6D23E26 |
25.71 |
5.49 |
-8.86 |
-0.87 |
0 |
|
|
319755 |
126657190 |
2 |
NC6H13 |
AB6C13 |
-35.3 |
1.8 |
-8.31 |
2.8 |
0 |
|
|
319756 |
126657192 |
1 |
NH9C13 |
AB9C13 |
80.14 |
1.85 |
-9.06 |
-0.91 |
0 |
|
|
319757 |
126657198 |
2 |
NO3H9C11 |
AB3C9D11 |
-187.99 |
4.99 |
-9.64 |
-1.04 |
0 |
|
|
319758 |
126657199 |
2 |
NOC6H9 |
ABC6D9 |
8.9 |
0.22 |
-9.24 |
-0.74 |
0 |
|
|
319762 |
126657231 |
1 |
ClFNO3H19C20 |
ABCD3E19F20 |
-159.44 |
6.21 |
-9.64 |
-0.81 |
0 |
|
|
319763 |
126657232 |
1 |
ClNO5C26H34 |
ABC5D26E34 |
-239.55 |
4.72 |
-9.23 |
-0.32 |
0 |
|
|
319764 |
126657241 |
1 |
ClS2N5O9C28H36 |
AB2C5D9E28F36 |
-316.5 |
8.15 |
-9.12 |
-1.18 |
0 |
|
|
319768 |
126657251 |
1 |
O3C17H28 |
A3B17C28 |
-150.17 |
4.22 |
-10.15 |
2.0 |
0 |
|
|
319771 |
126657259 |
1 |
ClSN5O9C27H34 |
ABC5D9E27F34 |
-337.11 |
4.66 |
-9.1 |
-0.96 |
0 |
|
|
319772 |
126657260 |
2 |
OC7H14 |
AB7C14 |
-142.57 |
1.75 |
-9.7 |
2.04 |
0 |
|
|
319774 |
126657267 |
2 |
OC9H19 |
AB9C19 |
-169.08 |
2.81 |
-9.79 |
1.92 |
0 |
|
|
319775 |
126657268 |
1 |
N16O20H58C65 |
A16B20C58D65 |
223.43 |
32.53 |
-6.55 |
-2.91 |
0 |
|
|
319776 |
126657270 |
1 |
ON2C18H34 |
AB2C18D34 |
-59.19 |
1.86 |
-10.45 |
-0.15 |
0 |
|
|
319777 |
126657271 |
1 |
N2C17H32 |
A2B17C32 |
-38.77 |
4.53 |
-9.08 |
0.8 |
0 |
|
|
319779 |
126657275 |
1 |
NOC11H17 |
ABC11D17 |
-54.86 |
4.93 |
-8.96 |
-0.4 |
0 |
|
|
319780 |
126657279 |
1 |
NO2C14H27 |
AB2C14D27 |
-138.86 |
6.07 |
-10.12 |
0.88 |
0 |
|
|
319781 |
126657280 |
1 |
NO2C17H33 |
AB2C17D33 |
-153.76 |
6.33 |
-10.14 |
0.89 |
0 |
|
|
319782 |
126657285 |
2 |
OC9H18 |
AB9C18 |
-171.43 |
5.27 |
-10.46 |
0.78 |
0 |
|
|
319783 |
126657288 |
1 |
O3C17H30 |
A3B17C30 |
-172.07 |
5.38 |
-9.55 |
0.18 |
0 |
|
|
319784 |
126657290 |
1 |
ClFNO6C30H35 |
ABCD6E30F35 |
-304.93 |
3.53 |
-9.39 |
-0.6 |
0 |
|
|
319785 |
126657293 |
1 |
ISF2N3H10C14 |
ABC2D3E10F14 |
21.1 |
1.3 |
-8.85 |
-2.7 |
0 |
|
|
319787 |
126657295 |
1 |
IO2N3C9H12 |
AB2C3D9E12 |
-18.44 |
2.3 |
-9.14 |
-1.38 |
0 |
|
|
319788 |
126657305 |
1 |
NO2C8H11 |
AB2C8D11 |
-24.47 |
3.12 |
-9.05 |
-0.1 |
0 |
|
|
319789 |
126657306 |
1 |
SO3C12H24 |
AB3C12D24 |
-176.35 |
4.7 |
-10.85 |
0.75 |
0 |
|
|
319792 |
126657311 |
1 |
NO2C10H19 |
AB2C10D19 |
-124.09 |
5.87 |
-10.06 |
0.99 |
0 |
|
|
319793 |
126657316 |
1 |
IO4C9H17 |
AB4C9D17 |
-181.13 |
3.11 |
-9.75 |
-2.73 |
0 |
|
|
319794 |
126657319 |
1 |
NO2C15H31 |
AB2C15D31 |
-156.68 |
3.32 |
-10.29 |
0.96 |
0 |
|
|
319795 |
126657320 |
1 |
NO2C15H31 |
AB2C15D31 |
-156.53 |
2.74 |
-10.17 |
0.85 |
0 |
|
|
319796 |
126657321 |
1 |
OSN3C16H29 |
ABC3D16E29 |
-27.03 |
4.3 |
-8.32 |
-0.07 |
0 |
|
|
319798 |
126657323 |
1 |
N2O2C13H26 |
A2B2C13D26 |
-140.51 |
0.76 |
-9.86 |
0.7 |
0 |
|
|
319799 |
126657324 |
2 |
NOC7H14 |
ABC7D14 |
-144.51 |
1.57 |
-9.87 |
0.64 |
0 |
|
|
319800 |
126657326 |
1 |
NO3C17H25 |
AB3C17D25 |
-125.22 |
2.66 |
-8.26 |
0.11 |
0 |
|
|
319801 |
126657328 |
1 |
NOC10H11 |
ABC10D11 |
-1.74 |
2.89 |
-9.85 |
-0.77 |
0 |
|
|
319804 |
126657331 |
1 |
O2C17H36 |
A2B17C36 |
-176.4 |
2.72 |
-10.25 |
2.43 |
0 |
|
|
319805 |
126657333 |
1 |
PC8H17 |
AB8C17 |
-21.25 |
1.47 |
-8.98 |
1.23 |
0 |