List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
199995 |
79329532 |
1 |
NOC14H19 |
ABC14D19 |
-16.63 |
3.02 |
-8.43 |
0.3 |
0 |
|
|
199996 |
79329576 |
1 |
N2C17H22 |
A2B17C22 |
37.55 |
1.85 |
-8.9 |
-0.55 |
0 |
|
|
199997 |
79329733 |
1 |
BrNSC10H14 |
ABCD10E14 |
29.53 |
2.84 |
-9.1 |
-0.34 |
0 |
|
|
199998 |
79329785 |
1 |
NC13H27 |
AB13C27 |
-38.19 |
1.04 |
-8.73 |
1.27 |
0 |
|
|
199999 |
79329786 |
1 |
NOC17H27 |
ABC17D27 |
-45.27 |
1.41 |
-8.46 |
0.41 |
0 |
|
|
200000 |
79330206 |
1 |
NS2C16H21 |
AB2C16D21 |
42.48 |
3.88 |
-8.41 |
-0.49 |
0 |
|
|
200001 |
79330212 |
1 |
BrNOC17H26 |
ABCD17E26 |
-37.78 |
3.19 |
-8.76 |
-0.04 |
0 |
|
|
200002 |
79330213 |
1 |
ClNO2C16H24 |
ABC2D16E24 |
-68.57 |
4.85 |
-8.37 |
0.21 |
0 |
|
|
200003 |
79330359 |
1 |
ClFNC14H19 |
ABCD14E19 |
-46.48 |
4.16 |
-9.13 |
-0.26 |
0 |
|
|
200004 |
79330360 |
1 |
NF3C14H18 |
AB3C14D18 |
-126.5 |
4.73 |
-9.21 |
-0.43 |
0 |
|
|
200005 |
79330361 |
1 |
NC12H25 |
AB12C25 |
-36.28 |
1.0 |
-8.75 |
1.28 |
0 |
|
|
200006 |
79330439 |
1 |
ClN2C17H21 |
AB2C17D21 |
27.64 |
2.93 |
-9.06 |
-0.73 |
0 |
|
|
200007 |
79330833 |
1 |
NOC14H19 |
ABC14D19 |
-9.65 |
4.04 |
-8.27 |
0.3 |
0 |
|
|
200008 |
79330834 |
1 |
OC14H18 |
AB14C18 |
-23.15 |
2.64 |
-9.36 |
0.19 |
0 |
|
|
200009 |
79330958 |
1 |
NOSC10H13 |
ABCD10E13 |
27.21 |
1.08 |
-9.26 |
-0.54 |
0 |
|
|
200010 |
79331559 |
1 |
NOSC10H13 |
ABCD10E13 |
-3.27 |
1.68 |
-9.3 |
-0.63 |
0 |
|
|
200011 |
79331560 |
1 |
BrOSC10H11 |
ABCD10E11 |
1.32 |
2.02 |
-9.25 |
-0.62 |
0 |
|
|
200012 |
79331561 |
1 |
NOC12H15 |
ABC12D15 |
-6.91 |
3.94 |
-9.49 |
-0.19 |
0 |
|
|
200013 |
79331562 |
1 |
NO2C12H15 |
AB2C12D15 |
-42.12 |
1.94 |
-9.36 |
-0.28 |
0 |
|
|
200014 |
79331563 |
1 |
OC15H20 |
AB15C20 |
-35.52 |
2.07 |
-8.95 |
0.38 |
0 |
|
|
200015 |
79331674 |
1 |
NOC12H15 |
ABC12D15 |
-7.89 |
3.7 |
-9.86 |
-0.01 |
0 |
|
|
200016 |
79331868 |
1 |
O2C15H20 |
A2B15C20 |
-53.73 |
3.61 |
-8.85 |
0.34 |
0 |
|
|
200017 |
79332019 |
1 |
FNC16H22 |
ABC16D22 |
-29.89 |
2.29 |
-9.16 |
-0.01 |
0 |
|
|
200018 |
79333240 |
1 |
NOSC15H21 |
ABCD15E21 |
-10.74 |
2.45 |
-9.03 |
0.2 |
0 |
|
|
200019 |
79333266 |
1 |
ClO2C12H15 |
AB2C12D15 |
-65.81 |
2.38 |
-9.26 |
-0.33 |
0 |
|
|
200020 |
79333267 |
1 |
O2C13H18 |
A2B13C18 |
-60.62 |
2.98 |
-9.27 |
0.22 |
0 |
|
|
200021 |
79333268 |
1 |
BrO2C12H15 |
AB2C12D15 |
-51.94 |
2.9 |
-8.97 |
-0.11 |
0 |
|
|
200022 |
79333282 |
1 |
BrFOC11H12 |
ABCD11E12 |
-60.3 |
2.97 |
-9.89 |
-0.58 |
0 |
|
|
200023 |
79333340 |
1 |
NOSC13H19 |
ABCD13E19 |
-20.04 |
3.75 |
-9.0 |
0.23 |
0 |
|
|
200024 |
79333484 |
1 |
BrOC11H13 |
ABC11D13 |
-16.6 |
3.23 |
-9.51 |
-0.05 |
0 |
|
|
200025 |
79333842 |
1 |
NC12H17 |
AB12C17 |
18.47 |
0.93 |
-8.99 |
0.44 |
0 |
|
|
200026 |
79333877 |
1 |
OC16H30 |
AB16C30 |
-88.73 |
2.24 |
-9.62 |
2.68 |
0 |
|
|
200027 |
79334555 |
1 |
OSN2C10H12 |
ABC2D10E12 |
9.37 |
4.83 |
-8.5 |
-0.58 |
0 |
|
|
200028 |
79334556 |
1 |
ON3C11H11 |
AB3C11D11 |
56.53 |
2.59 |
-9.08 |
-0.78 |
0 |
|
|
200029 |
79334889 |
1 |
O3C12H14 |
A3B12C14 |
-88.44 |
3.07 |
-8.68 |
-0.15 |
0 |
|
|
200030 |
79334939 |
1 |
ClO3C13H17 |
AB3C13D17 |
-125.71 |
2.35 |
-9.01 |
-0.47 |
0 |
|
|
200031 |
79335178 |
1 |
BrF2O2H11C12 |
AB2C2D11E12 |
-145.0 |
4.65 |
-9.53 |
-1.06 |
0 |
|
|
200032 |
79335179 |
1 |
ClOSN2H9C10 |
ABCD2E9F10 |
37.44 |
3.25 |
-8.99 |
-0.89 |
0 |
|
|
200033 |
79335217 |
1 |
NOC15H21 |
ABC15D21 |
-28.83 |
2.74 |
-8.09 |
0.43 |
0 |
|
|
200034 |
79335499 |
1 |
ClNC15H16 |
ABC15D16 |
31.98 |
0.81 |
-9.19 |
-0.71 |
0 |
|
|
200035 |
79335812 |
1 |
BrNO3H8C9 |
ABC3D8E9 |
-13.21 |
4.41 |
-9.85 |
-1.32 |
0 |
|
|
200036 |
79335839 |
1 |
BrNSO3H8C10 |
ABCD3E8F10 |
-71.28 |
3.16 |
-9.45 |
-1.94 |
0 |
|
|
200037 |
79335849 |
1 |
BrN2O3C12H15 |
AB2C3D12E15 |
-109.82 |
3.14 |
-8.98 |
-0.81 |
0 |
|
|
200038 |
79336149 |
1 |
ClNSO3C10H10 |
ABCD3E10F10 |
-107.24 |
2.02 |
-9.23 |
-1.23 |
0 |
|
|
200039 |
79336293 |
1 |
ClFNO4C13H13 |
ABCD4E13F13 |
-170.82 |
3.57 |
-9.51 |
-1.8 |
0 |
|
|
200040 |
79336294 |
1 |
ClN2O2C13H15 |
AB2C2D13E15 |
-57.14 |
8.11 |
-8.84 |
-1.26 |
0 |
|
|
200041 |
79336947 |
1 |
N2O2C15H28 |
A2B2C15D28 |
-130.52 |
3.93 |
-9.45 |
0.95 |
0 |
|
|
200042 |
79337110 |
1 |
FN2O2C14H19 |
AB2C2D14E19 |
-125.45 |
1.5 |
-8.94 |
-0.31 |
0 |
|
|
200043 |
79337340 |
1 |
N3O4C11H15 |
A3B4C11D15 |
-85.26 |
7.23 |
-9.64 |
-1.44 |
0 |
|
|
200044 |
79337444 |
2 |
ClNOC5H5 |
ABCD5E5 |
-61.47 |
2.38 |
-9.44 |
-0.83 |
0 |