List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
198995 |
79186455 |
1 |
SN3O3C14H17 |
AB3C3D14E17 |
-77.78 |
9.15 |
-9.35 |
-0.75 |
0 |
|
|
198996 |
79186482 |
1 |
SN2O3C14H18 |
AB2C3D14E18 |
-80.44 |
6.53 |
-9.46 |
-0.99 |
0 |
|
|
198997 |
79186909 |
1 |
BrFSN2O2C13H18 |
ABCD2E2F13G18 |
-115.05 |
4.82 |
-9.59 |
-0.9 |
0 |
|
|
198998 |
79186910 |
2 |
NOSC7H12 |
ABCD7E12 |
-80.61 |
3.86 |
-9.23 |
-0.89 |
0 |
|
|
198999 |
79186911 |
1 |
SCl2N2O2C13H18 |
AB2C2D2E13F18 |
-87.52 |
3.31 |
-9.69 |
-1.14 |
0 |
|
|
199000 |
79186912 |
1 |
SO2N4C13H24 |
AB2C4D13E24 |
-59.46 |
7.88 |
-9.37 |
0.02 |
0 |
|
|
199001 |
79186913 |
1 |
SO2N4C11H20 |
AB2C4D11E20 |
-72.17 |
6.04 |
-9.5 |
0.01 |
0 |
|
|
199002 |
79186914 |
1 |
SN2O2C11H22 |
AB2C2D11E22 |
-84.87 |
2.97 |
-9.18 |
0.5 |
0 |
|
|
199003 |
79186957 |
1 |
FSN2O3C13H19 |
ABC2D3E13F19 |
-149.17 |
6.57 |
-8.71 |
-1.02 |
0 |
|
|
199004 |
79186980 |
1 |
SO2N3C12H25 |
AB2C3D12E25 |
-111.32 |
2.49 |
-9.38 |
0.07 |
0 |
|
|
199005 |
79187014 |
1 |
FSO4C12H13 |
ABC4D12E13 |
-182.21 |
2.41 |
-10.04 |
-1.66 |
0 |
|
|
199006 |
79187015 |
1 |
FNSO5C11H12 |
ABCD5E11F12 |
-231.28 |
3.47 |
-10.19 |
-1.68 |
0 |
|
|
199007 |
79187071 |
1 |
FSN2O5C11H13 |
ABC2D5E11F13 |
-232.57 |
8.44 |
-10.01 |
-1.4 |
0 |
|
|
199008 |
79187072 |
1 |
ClFNSO2C12H17 |
ABCDE2F12G17 |
-127.97 |
5.47 |
-9.33 |
-1.09 |
0 |
|
|
199009 |
79187073 |
1 |
ClFNS2O4C11H13 |
ABCD2E4F11G13 |
-202.48 |
8.52 |
-10.32 |
-1.44 |
0 |
|
|
199010 |
79187143 |
1 |
ClFNSO2C13H19 |
ABCDE2F13G19 |
-137.97 |
4.33 |
-9.49 |
-0.99 |
0 |
|
|
199011 |
79187144 |
1 |
ClFNSO2C13H19 |
ABCDE2F13G19 |
-136.61 |
3.89 |
-9.36 |
-1.0 |
0 |
|
|
199012 |
79187145 |
1 |
FNSO5C11H14 |
ABCD5E11F14 |
-225.34 |
3.32 |
-10.1 |
-1.6 |
0 |
|
|
199013 |
79187757 |
1 |
NSO3C15H23 |
ABC3D15E23 |
-137.6 |
4.28 |
-9.45 |
-0.44 |
0 |
|
|
199014 |
79187758 |
1 |
NSO3C15H23 |
ABC3D15E23 |
-131.15 |
6.83 |
-9.5 |
-0.46 |
0 |
|
|
199015 |
79187759 |
1 |
SN3O3C11H19 |
AB3C3D11E19 |
-117.87 |
5.25 |
-9.35 |
0.01 |
0 |
|
|
199016 |
79187760 |
1 |
SO2N3C13H29 |
AB2C3D13E29 |
-112.03 |
4.44 |
-8.71 |
0.18 |
0 |
|
|
199017 |
79187761 |
1 |
SO2N4C12H22 |
AB2C4D12E22 |
-70.63 |
7.73 |
-8.92 |
-0.04 |
0 |
|
|
199018 |
79187762 |
1 |
SN2O2C12H24 |
AB2C2D12E24 |
-90.98 |
5.11 |
-9.05 |
0.42 |
0 |
|
|
199019 |
79189002 |
2 |
N2C6H9 |
A2B6C9 |
32.74 |
2.15 |
-8.48 |
-0.13 |
0 |
|
|
199020 |
79189292 |
1 |
F3N3C14H18 |
A3B3C14D18 |
-140.44 |
6.18 |
-8.64 |
-0.28 |
0 |
|
|
199021 |
79189509 |
1 |
NF2C11H13 |
AB2C11D13 |
-71.77 |
2.03 |
-9.45 |
-0.36 |
0 |
|
|
199022 |
79189510 |
1 |
N3C8H11 |
A3B8C11 |
51.91 |
1.66 |
-9.65 |
-0.78 |
0 |
|
|
199023 |
79189866 |
1 |
NSC10H15 |
ABC10D15 |
17.8 |
1.88 |
-9.05 |
-0.09 |
0 |
|
|
199024 |
79189960 |
1 |
FNC12H16 |
ABC12D16 |
-26.16 |
0.6 |
-9.1 |
-0.03 |
0 |
|
|
199025 |
79189961 |
1 |
FNC15H22 |
ABC15D22 |
-46.73 |
3.51 |
-8.85 |
0.1 |
0 |
|
|
199026 |
79189962 |
1 |
NOC12H17 |
ABC12D17 |
-15.69 |
2.31 |
-8.71 |
0.28 |
0 |
|
|
199027 |
79190009 |
2 |
OC7H10 |
AB7C10 |
-84.19 |
3.21 |
-8.7 |
0.37 |
0 |
|
|
199028 |
79190262 |
1 |
ON2C8H10 |
AB2C8D10 |
18.59 |
5.37 |
-9.86 |
-0.18 |
0 |
|
|
199029 |
79190312 |
1 |
ClFNC14H19 |
ABCD14E19 |
-47.98 |
2.36 |
-8.7 |
-0.24 |
0 |
|
|
199030 |
79190571 |
1 |
O2C13H18 |
A2B13C18 |
-75.65 |
3.26 |
-8.51 |
0.38 |
0 |
|
|
199031 |
79190572 |
2 |
OC6H7 |
AB6C7 |
-56.77 |
2.74 |
-8.78 |
0.04 |
0 |
|
|
199032 |
79190573 |
1 |
O2C13H16 |
A2B13C16 |
-67.12 |
2.72 |
-8.57 |
0.26 |
0 |
|
|
199033 |
79190574 |
1 |
OC12H16 |
AB12C16 |
-26.96 |
1.74 |
-9.3 |
0.46 |
0 |
|
|
199034 |
79190575 |
1 |
OC13H18 |
AB13C18 |
-39.18 |
2.27 |
-9.27 |
0.4 |
0 |
|
|
199035 |
79190576 |
1 |
OC12H22 |
AB12C22 |
-80.81 |
1.26 |
-9.22 |
1.48 |
0 |
|
|
199036 |
79190577 |
1 |
OC11H20 |
AB11C20 |
-76.55 |
1.29 |
-9.87 |
1.12 |
0 |
|
|
199037 |
79190578 |
1 |
NOC14H15 |
ABC14D15 |
-1.27 |
3.77 |
-9.31 |
-0.69 |
0 |
|
|
199038 |
79190579 |
1 |
ClO2C11H13 |
AB2C11D13 |
-64.7 |
3.4 |
-8.9 |
-0.2 |
0 |
|
|
199039 |
79190580 |
1 |
OC14H20 |
AB14C20 |
-44.57 |
0.41 |
-9.14 |
0.47 |
0 |
|
|
199040 |
79190581 |
2 |
OC6H8 |
AB6C8 |
-59.63 |
4.03 |
-9.6 |
0.05 |
0 |
|
|
199041 |
79190582 |
1 |
ON2C10H16 |
AB2C10D16 |
-26.59 |
6.28 |
-9.17 |
0.6 |
0 |
|
|
199042 |
79190583 |
1 |
ON2C10H16 |
AB2C10D16 |
-21.48 |
3.4 |
-9.23 |
0.53 |
0 |
|
|
199043 |
79190584 |
1 |
OC13H16 |
AB13C16 |
-20.02 |
3.61 |
-9.66 |
-0.45 |
0 |
|
|
199044 |
79190585 |
1 |
NOC11H13 |
ABC11D13 |
-14.24 |
2.4 |
-9.62 |
-0.09 |
0 |