List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
337994 |
127258617 |
2 |
OC5H9 |
AB5C9 |
-117.64 |
1.49 |
-9.11 |
0.9 |
0 |
|
|
337995 |
127258618 |
2 |
OC6H10 |
AB6C10 |
-115.7 |
2.88 |
-9.08 |
0.93 |
0 |
|
|
337996 |
127258619 |
2 |
OC5H9 |
AB5C9 |
-111.08 |
2.5 |
-9.81 |
0.87 |
0 |
|
|
337997 |
127258620 |
1 |
O2C11H22 |
A2B11C22 |
-138.87 |
1.96 |
-10.58 |
0.91 |
0 |
|
|
337998 |
127258621 |
2 |
O3C8H16 |
A3B8C16 |
-198.37 |
2.04 |
-8.98 |
-0.36 |
0 |
|
|
337999 |
127258622 |
2 |
OC7H14 |
AB7C14 |
-153.07 |
1.72 |
-10.49 |
0.89 |
0 |
|
|
338000 |
127258623 |
1 |
SO2C35H70 |
AB2C35D70 |
-254.07 |
3.08 |
-8.66 |
0.68 |
0 |
|
|
338001 |
127258624 |
4 |
OC4H8 |
AB4C8 |
-234.4 |
1.04 |
-9.82 |
0.98 |
0 |
|
|
338002 |
127258625 |
1 |
NO6C11H17 |
AB6C11D17 |
-242.28 |
4.99 |
-9.73 |
-0.52 |
0 |
|
|
338003 |
127258626 |
2 |
ClO2C8H11 |
AB2C8D11 |
-188.98 |
2.19 |
-9.01 |
-0.48 |
0 |
|
|
338004 |
127258627 |
1 |
Cl2O3C18H26 |
A2B3C18D26 |
-171.11 |
2.63 |
-8.88 |
-0.38 |
0 |
|
|
338005 |
127258628 |
1 |
NCl2O4C16H19 |
AB2C4D16E19 |
-172.63 |
6.77 |
-9.1 |
-0.6 |
0 |
|
|
338006 |
127258629 |
1 |
Cl2O3C18H26 |
A2B3C18D26 |
-172.61 |
4.6 |
-8.86 |
-0.39 |
0 |
|
|
338007 |
127258630 |
1 |
NO2C20H41 |
AB2C20D41 |
-180.14 |
2.48 |
-9.43 |
0.76 |
0 |
|
|
338008 |
127258631 |
1 |
NO2C11H15 |
AB2C11D15 |
-83.76 |
2.64 |
-8.51 |
0.28 |
0 |
|
|
338009 |
127258632 |
1 |
ClSN2O6C21H25 |
ABC2D6E21F25 |
-231.57 |
7.66 |
-9.39 |
-0.96 |
0 |
|
|
338010 |
127258633 |
1 |
N5O8C25H33 |
A5B8C25D33 |
-322.85 |
4.35 |
-9.56 |
-0.41 |
0 |
|
|
338011 |
127258634 |
1 |
O9C21H28 |
A9B21C28 |
-380.62 |
4.24 |
-8.93 |
-1.16 |
0 |
|
|
338013 |
127258636 |
1 |
NO3C13H29 |
AB3C13D29 |
-205.71 |
2.05 |
-10.17 |
1.42 |
0 |
|
|
338014 |
127258637 |
1 |
NO3C12H25 |
AB3C12D25 |
-178.08 |
1.66 |
-9.94 |
1.3 |
0 |
|
|
338015 |
127258638 |
1 |
NO3C12H15 |
AB3C12D15 |
-107.5 |
2.22 |
-9.77 |
-0.21 |
0 |
|
|
338016 |
127258639 |
1 |
NO3C8H15 |
AB3C8D15 |
-159.25 |
3.19 |
-10.0 |
0.65 |
0 |
|
|
338017 |
127258640 |
1 |
NO2C18H19 |
AB2C18D19 |
-58.39 |
2.32 |
-9.1 |
-0.06 |
0 |
|
|
338018 |
127258641 |
1 |
N3O3C6H7 |
A3B3C6D7 |
-100.08 |
5.98 |
-9.83 |
-0.85 |
0 |
|
|
338019 |
127258642 |
1 |
NO5C15H19 |
AB5C15D19 |
-212.3 |
4.8 |
-10.32 |
-0.88 |
0 |
|
|
338020 |
127258651 |
1 |
NO3C11H21 |
AB3C11D21 |
-167.22 |
2.0 |
-9.81 |
0.55 |
0 |
|
|
338021 |
127258652 |
1 |
NO3C14H17 |
AB3C14D17 |
-104.14 |
3.57 |
-9.7 |
-0.46 |
0 |
|
|
338022 |
127258653 |
1 |
NO3C17H17 |
AB3C17D17 |
-75.34 |
4.58 |
-9.6 |
-0.18 |
0 |
|
|
338023 |
127258654 |
1 |
NO3C11H21 |
AB3C11D21 |
-168.72 |
1.66 |
-9.82 |
0.53 |
0 |
|
|
338024 |
127258655 |
1 |
NO3C15H21 |
AB3C15D21 |
-131.25 |
1.48 |
-9.32 |
0.41 |
0 |
|
|
338025 |
127258656 |
1 |
N2O3C10H18 |
A2B3C10D18 |
-158.75 |
5.1 |
-9.59 |
0.75 |
0 |
|
|
338026 |
127258657 |
1 |
N2O3C15H20 |
A2B3C15D20 |
-119.3 |
5.38 |
-9.44 |
-0.02 |
0 |
|
|
338027 |
127258658 |
1 |
NO3C9H17 |
AB3C9D17 |
-157.67 |
1.91 |
-9.86 |
0.51 |
0 |
|
|
338028 |
127258659 |
1 |
NO4H15C16 |
AB4C15D16 |
-114.15 |
5.23 |
-9.61 |
-1.04 |
0 |
|
|
338029 |
127258660 |
1 |
NO3C11H23 |
AB3C11D23 |
-181.27 |
1.98 |
-9.44 |
1.08 |
0 |
|
|
338030 |
127258661 |
1 |
NO3C7H15 |
AB3C7D15 |
-154.13 |
3.06 |
-9.72 |
0.67 |
0 |
|
|
338031 |
127258662 |
1 |
NO3C14H21 |
AB3C14D21 |
-140.24 |
3.13 |
-9.3 |
0.42 |
0 |
|
|
338032 |
127258663 |
1 |
NO3C11H15 |
AB3C11D15 |
-116.0 |
1.84 |
-9.41 |
0.23 |
0 |
|
|
338033 |
127258664 |
1 |
NO3C7H13 |
AB3C7D13 |
-124.59 |
1.97 |
-9.86 |
0.59 |
0 |
|
|
338034 |
127258665 |
1 |
N2O2H16C17 |
A2B2C16D17 |
-21.37 |
2.32 |
-8.35 |
-0.23 |
0 |
|
|
338035 |
127258666 |
1 |
NO3C18H19 |
AB3C18D19 |
-88.03 |
4.84 |
-9.55 |
-0.5 |
0 |
|
|
338036 |
127258667 |
2 |
NOC4H8 |
ABC4D8 |
-105.99 |
0.97 |
-8.61 |
0.75 |
0 |
|
|
338037 |
127258668 |
1 |
NO2C14H19 |
AB2C14D19 |
-70.22 |
2.38 |
-9.62 |
0.03 |
0 |
|
|
338038 |
127258669 |
1 |
NO2C9H13 |
AB2C9D13 |
-56.81 |
2.21 |
-9.78 |
0.32 |
0 |
|
|
338039 |
127258670 |
1 |
NO4H9C11 |
AB4C9D11 |
-131.07 |
3.85 |
-9.31 |
-0.92 |
0 |
|
|
338040 |
127258671 |
1 |
NO4H9C11 |
AB4C9D11 |
-131.45 |
5.68 |
-9.36 |
-0.91 |
0 |
|
|
338041 |
127258672 |
1 |
NO3C18H19 |
AB3C18D19 |
-83.59 |
2.38 |
-9.35 |
-0.31 |
0 |
|
|
338042 |
127258673 |
1 |
NO2C11H13 |
AB2C11D13 |
-54.63 |
2.12 |
-9.51 |
0.24 |
0 |
|
|
338043 |
127258674 |
1 |
NO2C13H19 |
AB2C13D19 |
-98.07 |
2.1 |
-9.31 |
0.37 |
0 |
|
|
338044 |
127258675 |
1 |
NO2C15H21 |
AB2C15D21 |
-75.15 |
2.85 |
-9.67 |
-0.01 |
0 |