List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
386970 |
134983542 |
2 |
O2C15H22 |
A2B15C22 |
-201.74 |
5.03 |
-9.37 |
-0.36 |
0 |
|
|
386971 |
134983546 |
1 |
FeO3C11H14 |
AB3C11D14 |
80.35 |
0.67 |
-7.23 |
0.52 |
0 |
|
|
386972 |
134983547 |
1 |
FeO4C18H18 |
AB4C18D18 |
100.97 |
1.68 |
-7.64 |
-0.37 |
0 |
|
|
386973 |
134983548 |
1 |
OC15H18 |
AB15C18 |
-6.0 |
3.25 |
-8.98 |
-0.5 |
0 |
|
|
386974 |
134983555 |
1 |
NO2C27H31 |
AB2C27D31 |
-8.14 |
2.42 |
-8.59 |
0.05 |
0 |
|
|
386975 |
134983564 |
2 |
NC7H10 |
AB7C10 |
57.61 |
4.16 |
-9.94 |
0.47 |
0 |
|
|
386976 |
134983568 |
1 |
SiC9H16 |
AB9C16 |
4.06 |
1.46 |
-8.41 |
0.69 |
0 |
|
|
386977 |
134983570 |
1 |
H18C25 |
A18B25 |
102.56 |
0.65 |
-8.82 |
-0.44 |
0 |
|
|
386978 |
134983574 |
4 |
H4C5 |
A4B5 |
104.87 |
0.07 |
-8.89 |
-0.12 |
0 |
|
|
386979 |
134983576 |
1 |
NC16H19 |
AB16C19 |
108.78 |
3.26 |
-7.86 |
-0.24 |
0 |
|
|
386980 |
134983583 |
2 |
O2C9H9 |
A2B9C9 |
-107.66 |
2.77 |
-8.63 |
-0.53 |
0 |
|
|
386981 |
134983584 |
1 |
SC19H22 |
AB19C22 |
10.3 |
2.71 |
-8.35 |
0.16 |
0 |
|
|
386982 |
134983589 |
3 |
OC7H8 |
AB7C8 |
-91.26 |
5.09 |
-8.91 |
-0.52 |
0 |
|
|
386983 |
134983590 |
1 |
O2C15H16 |
A2B15C16 |
-47.52 |
4.27 |
-9.02 |
-0.22 |
0 |
|
|
386984 |
134983596 |
1 |
O4C19H20 |
A4B19C20 |
-129.1 |
2.11 |
-8.31 |
-0.22 |
0 |
|
|
386985 |
134983599 |
2 |
OC23H35 |
AB23C35 |
-159.66 |
3.45 |
-8.65 |
-1.32 |
0 |
|
|
386986 |
134983615 |
2 |
OSiC16H25 |
ABC16D25 |
-172.62 |
2.21 |
-8.85 |
0.2 |
0 |
|
|
386987 |
134983616 |
1 |
OSi2C20H36 |
AB2C20D36 |
-81.74 |
1.87 |
-8.7 |
-0.12 |
0 |
|
|
386988 |
134983623 |
4 |
C5H7 |
A5B7 |
32.76 |
1.65 |
-8.59 |
0.0 |
0 |
|
|
386989 |
134983626 |
1 |
INH8C9 |
ABC8D9 |
77.16 |
3.36 |
-9.22 |
-0.89 |
0 |
|
|
386990 |
134983628 |
1 |
O2C13H20 |
A2B13C20 |
-86.79 |
3.95 |
-9.26 |
0.25 |
0 |
|
|
386991 |
134983631 |
2 |
NC6H9 |
AB6C9 |
25.98 |
3.89 |
-9.47 |
-0.23 |
0 |
|
|
386992 |
134983633 |
1 |
O3C14H16 |
A3B14C16 |
-101.16 |
3.63 |
-10.09 |
-0.64 |
0 |
|
|
386993 |
134983635 |
1 |
O4C17H22 |
A4B17C22 |
-164.97 |
1.45 |
-10.0 |
-0.52 |
0 |
|
|
386994 |
134983637 |
1 |
BO3C24H35 |
AB3C24D35 |
-172.99 |
4.34 |
-9.57 |
-0.1 |
0 |
|
|
386995 |
134983638 |
2 |
NOH13C14 |
ABC13D14 |
32.39 |
3.92 |
-7.78 |
-0.48 |
0 |
|
|
386996 |
134983643 |
2 |
O3C15H16 |
A3B15C16 |
-159.88 |
2.94 |
-9.25 |
0.15 |
0 |
|
|
386997 |
134983645 |
1 |
NSO4C21H29 |
ABC4D21E29 |
-147.96 |
6.66 |
-9.49 |
-0.66 |
0 |
|
|
386998 |
134983647 |
1 |
O2C11H20 |
A2B11C20 |
-93.42 |
3.0 |
-9.7 |
-0.19 |
0 |
|
|
387000 |
134983650 |
1 |
FeO3N4H8C10 |
AB3C4D8E10 |
125.04 |
8.21 |
-7.95 |
-0.7 |
0 |
|
|
387001 |
134983651 |
1 |
FePO6C30H31 |
ABC6D30E31 |
-60.1 |
5.48 |
-7.81 |
0.11 |
0 |
|
|
387002 |
134983652 |
1 |
OC10H16 |
AB10C16 |
-30.34 |
1.36 |
-8.94 |
0.55 |
0 |
|
|
387003 |
134983654 |
1 |
O5C14H20 |
A5B14C20 |
-193.8 |
4.72 |
-9.39 |
0.14 |
0 |
|
|
387004 |
134983661 |
1 |
O2C17H24 |
A2B17C24 |
-42.09 |
1.91 |
-8.52 |
0.46 |
0 |
|
|
387005 |
134983662 |
2 |
OC8H14 |
AB8C14 |
-105.66 |
2.44 |
-10.05 |
0.19 |
0 |
|
|
387006 |
134983663 |
1 |
O4H22C27 |
A4B22C27 |
-4.3 |
4.04 |
-8.89 |
-1.54 |
0 |
|
|
387007 |
134983664 |
2 |
O3C9H10 |
A3B9C10 |
-230.47 |
2.2 |
-9.22 |
-0.56 |
0 |
|
|
387008 |
134983666 |
1 |
BrC8H11 |
AB8C11 |
57.91 |
1.89 |
-8.97 |
0.02 |
0 |
|
|
387009 |
134983667 |
1 |
O4H18C21 |
A4B18C21 |
-50.5 |
3.85 |
-9.32 |
-0.49 |
0 |
|
|
387010 |
134983668 |
2 |
H15C22 |
A15B22 |
280.08 |
3.16 |
-8.22 |
-0.9 |
0 |
|
|
387011 |
134983670 |
1 |
O5C16H18 |
A5B16C18 |
-190.2 |
3.46 |
-9.57 |
-1.27 |
0 |
|
|
387012 |
134983677 |
1 |
SC18H20 |
AB18C20 |
20.0 |
2.68 |
-8.39 |
0.12 |
0 |
|
|
387013 |
134983679 |
1 |
FO5H13C18 |
AB5C13D18 |
-173.32 |
3.43 |
-9.25 |
-1.2 |
0 |
|
|
387014 |
134983680 |
1 |
NO3C26H31 |
AB3C26D31 |
-71.31 |
2.0 |
-8.28 |
-0.3 |
0 |
|
|
387015 |
134983683 |
1 |
O2C15H20 |
A2B15C20 |
-60.58 |
1.78 |
-8.08 |
0.38 |
0 |
|
|
387016 |
134983685 |
1 |
IH15C17 |
AB15C17 |
66.67 |
1.95 |
-8.96 |
-0.66 |
0 |
|
|
387017 |
134983686 |
1 |
SO3H22C24 |
AB3C22D24 |
-57.6 |
5.58 |
-9.36 |
-0.49 |
0 |
|
|
387018 |
134983689 |
1 |
O3C22H34 |
A3B22C34 |
-139.61 |
3.97 |
-8.04 |
-0.16 |
0 |
|
|
387019 |
134983692 |
1 |
O4C23H32 |
A4B23C32 |
-171.69 |
3.39 |
-8.89 |
-0.2 |
0 |
|
|
387020 |
134983694 |
1 |
NO5H29C30 |
AB5C29D30 |
-96.31 |
6.04 |
-8.38 |
-0.78 |
0 |
|
|
387021 |
134983695 |
1 |
N2O5H24C27 |
A2B5C24D27 |
-23.58 |
6.85 |
-8.81 |
-1.44 |
0 |
|
|
387022 |
134983700 |
3 |
C5H6 |
A5B6 |
11.79 |
0.84 |
-8.25 |
-0.07 |
0 |
|
|
387023 |
134983704 |
1 |
SiO3C20H38 |
AB3C20D38 |
-235.59 |
1.67 |
-8.69 |
0.68 |
0 |
|
|
387024 |
134983716 |
1 |
OC17H24 |
AB17C24 |
-25.29 |
2.19 |
-9.17 |
0.12 |
0 |
|
|
387025 |
134983717 |
1 |
NSO4C14H15 |
ABC4D14E15 |
-34.53 |
6.26 |
-9.09 |
-1.72 |
0 |
|
|
387026 |
134983727 |
1 |
Cl2N6H16C17 |
A2B6C16D17 |
111.08 |
6.09 |
-8.68 |
-1.16 |
0 |
|
|
387027 |
134983729 |
1 |
SbN3Cl6C13H16 |
AB3C6D13E16 |
-59.81 |
16.85 |
-10.58 |
-1.85 |
0 |
|
|
387028 |
134983736 |
1 |
FN4C6O6H11 |
AB4C6D6E11 |
-61.75 |
4.86 |
-11.13 |
-2.01 |
0 |
|
|
387029 |
134983737 |
1 |
N2O2C5H12 |
A2B2C5D12 |
-25.11 |
5.46 |
-10.14 |
-0.22 |
0 |
|
|
387030 |
134983738 |
2 |
NOC5H5 |
ABC5D5 |
70.98 |
1.21 |
-9.54 |
-0.91 |
0 |
|
|
387031 |
134983743 |
1 |
BrN2O3C10H17 |
AB2C3D10E17 |
-79.94 |
5.86 |
-10.22 |
-0.64 |
0 |
|
|
387032 |
134983744 |
2 |
N2O3C4H4 |
A2B3C4D4 |
14.78 |
7.32 |
-11.03 |
-2.14 |
0 |
|
|
387033 |
134983746 |
1 |
BrN2C19H23 |
AB2C19D23 |
34.25 |
3.8 |
-8.44 |
0.13 |
0 |
|
|
387034 |
134983751 |
1 |
SN3O5C31H37 |
AB3C5D31E37 |
-102.46 |
6.61 |
-8.65 |
-0.46 |
0 |
|
|
387035 |
134983757 |
1 |
NCl2O2C14H17 |
AB2C2D14E17 |
-67.75 |
1.53 |
-9.43 |
-0.31 |
0 |
|
|
387036 |
134983762 |
1 |
NO6C21H23 |
AB6C21D23 |
-200.81 |
3.38 |
-9.73 |
-0.38 |
0 |
|
|
387037 |
134983764 |
1 |
NO2C22H27 |
AB2C22D27 |
-35.36 |
1.26 |
-9.28 |
0.2 |
0 |
|
|
387038 |
134983766 |
1 |
NSO6C26H31 |
ABC6D26E31 |
-184.94 |
6.89 |
-9.57 |
-0.64 |
0 |
|
|
387039 |
134983768 |
1 |
NCl3H12C15 |
AB3C12D15 |
60.32 |
1.53 |
-9.58 |
-0.42 |
0 |
|
|
387040 |
134983771 |
1 |
NO2H23C24 |
AB2C23D24 |
13.06 |
1.62 |
-9.28 |
0.07 |
0 |
|
|
387041 |
134983776 |
1 |
NSO2C23H29 |
ABC2D23E29 |
-39.63 |
4.8 |
-8.88 |
-0.03 |
0 |
|
|
387042 |
134983777 |
1 |
NOSC21H23 |
ABCD21E23 |
41.93 |
0.96 |
-9.09 |
-0.18 |
0 |
|
|
387043 |
134983779 |
1 |
NO4C26H27 |
AB4C26D27 |
-61.72 |
3.24 |
-9.35 |
-0.21 |
0 |
|
|
387044 |
134983780 |
1 |
N3O8C15H19 |
A3B8C15D19 |
-266.96 |
2.32 |
-9.71 |
-0.6 |
0 |
|
|
387045 |
134983781 |
1 |
N2O8C9H14 |
A2B8C9D14 |
-201.44 |
4.03 |
-11.52 |
-1.13 |
0 |