List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
212945 |
81062374 |
1 |
ON3C10H21 |
AB3C10D21 |
-22.58 |
5.27 |
-9.14 |
1.47 |
0 |
|
|
212946 |
81062381 |
1 |
FN2O3C13H19 |
AB2C3D13E19 |
-162.06 |
1.54 |
-8.64 |
-0.52 |
0 |
|
|
212947 |
81062382 |
1 |
N2O3C15H30 |
A2B3C15D30 |
-154.2 |
2.9 |
-8.91 |
1.04 |
0 |
|
|
212948 |
81062383 |
1 |
N2O3C11H22 |
A2B3C11D22 |
-146.23 |
5.75 |
-8.99 |
0.7 |
0 |
|
|
212949 |
81062385 |
1 |
N2O3C13H28 |
A2B3C13D28 |
-156.47 |
2.77 |
-8.94 |
1.15 |
0 |
|
|
212950 |
81062386 |
1 |
N2O3C12H24 |
A2B3C12D24 |
-118.69 |
2.14 |
-9.01 |
0.9 |
0 |
|
|
212951 |
81062387 |
1 |
N2O3C14H20 |
A2B3C14D20 |
-112.01 |
3.57 |
-8.91 |
-0.44 |
0 |
|
|
212952 |
81062388 |
1 |
N2O3C15H24 |
A2B3C15D24 |
-134.72 |
3.34 |
-8.75 |
0.07 |
0 |
|
|
212953 |
81062389 |
1 |
O2N3C14H23 |
A2B3C14D23 |
-79.09 |
4.19 |
-8.66 |
0.26 |
0 |
|
|
212954 |
81062390 |
1 |
N2O3C12H24 |
A2B3C12D24 |
-152.23 |
5.8 |
-9.52 |
1.15 |
0 |
|
|
212955 |
81062391 |
1 |
N2O3C15H24 |
A2B3C15D24 |
-104.45 |
5.22 |
-9.26 |
0.03 |
0 |
|
|
212956 |
81062394 |
1 |
NSO4C14H19 |
ABC4D14E19 |
-139.27 |
9.15 |
-9.49 |
-1.16 |
0 |
|
|
212957 |
81062399 |
1 |
N2O3C15H30 |
A2B3C15D30 |
-137.95 |
1.14 |
-8.69 |
0.81 |
0 |
|
|
212958 |
81062400 |
1 |
N2O3C13H26 |
A2B3C13D26 |
-127.66 |
3.04 |
-8.98 |
0.95 |
0 |
|
|
212959 |
81062403 |
1 |
SN3O3C12H21 |
AB3C3D12E21 |
-105.5 |
5.51 |
-8.96 |
-0.37 |
0 |
|
|
212960 |
81062410 |
2 |
NO2C7H14 |
AB2C7D14 |
-215.21 |
7.27 |
-9.52 |
0.53 |
0 |
|
|
212961 |
81062412 |
1 |
SO3N4C12H22 |
AB3C4D12E22 |
-96.07 |
6.63 |
-9.14 |
-0.74 |
0 |
|
|
212962 |
81062417 |
1 |
FN2O3C11H15 |
AB2C3D11E15 |
-67.66 |
7.34 |
-9.04 |
-0.76 |
0 |
|
|
212963 |
81062419 |
1 |
ClOSN3C11H18 |
ABCD3E11F18 |
-26.43 |
6.98 |
-8.73 |
-0.4 |
0 |
|
|
212964 |
81062420 |
1 |
OCl2N2C12H18 |
AB2C2D12E18 |
-49.26 |
3.07 |
-8.52 |
-0.47 |
0 |
|
|
212965 |
81062421 |
1 |
OCl2N3C10H15 |
AB2C3D10E15 |
-27.91 |
4.48 |
-9.02 |
-0.76 |
0 |
|
|
212966 |
81062422 |
1 |
ClO2N4C10H17 |
AB2C4D10E17 |
-52.22 |
2.51 |
-9.34 |
-0.47 |
0 |
|
|
212967 |
81062423 |
1 |
BrNOC10H20 |
ABCD10E20 |
-40.59 |
1.95 |
-8.7 |
-0.1 |
0 |
|
|
212968 |
81062424 |
1 |
BrNOC10H22 |
ABCD10E22 |
-69.1 |
2.4 |
-9.02 |
0.21 |
0 |
|
|
212969 |
81062425 |
1 |
N3O3C13H25 |
A3B3C13D25 |
-109.26 |
2.82 |
-9.07 |
0.56 |
0 |
|
|
212970 |
81062426 |
1 |
BrNOC12H26 |
ABCD12E26 |
-83.5 |
2.87 |
-8.94 |
0.19 |
0 |
|
|
212971 |
81062427 |
1 |
N3O3C9H19 |
A3B3C9D19 |
-110.43 |
4.77 |
-8.88 |
0.83 |
0 |
|
|
212972 |
81062428 |
1 |
N3O3C14H21 |
A3B3C14D21 |
-76.09 |
0.91 |
-9.19 |
-0.59 |
0 |
|
|
212973 |
81062429 |
1 |
N2S2O5C11H18 |
A2B2C5D11E18 |
-173.08 |
4.17 |
-9.69 |
-1.03 |
0 |
|
|
212974 |
81062430 |
1 |
ON4C8H18 |
AB4C8D18 |
15.07 |
4.17 |
-9.13 |
0.12 |
0 |
|
|
212975 |
81062432 |
1 |
INOC12H18 |
ABCD12E18 |
-11.27 |
2.06 |
-8.99 |
-0.82 |
0 |
|
|
212976 |
81062433 |
1 |
BNO3C12H20 |
ABC3D12E20 |
-195.52 |
6.11 |
-8.98 |
0.62 |
0 |
|
|
212977 |
81062434 |
1 |
ClSN2O4C11H17 |
ABC2D4E11F17 |
-161.69 |
3.28 |
-9.61 |
-1.2 |
0 |
|
|
212978 |
81062435 |
1 |
BFNO3C13H21 |
ABCD3E13F21 |
-235.75 |
4.09 |
-9.12 |
-0.19 |
0 |
|
|
212979 |
81062436 |
1 |
NO4C13H17 |
AB4C13D17 |
-145.96 |
7.36 |
-9.54 |
-0.86 |
0 |
|
|
212980 |
81062440 |
1 |
NO2C16H23 |
AB2C16D23 |
-39.57 |
3.08 |
-8.97 |
-0.08 |
0 |
|
|
212981 |
81062441 |
1 |
NSO2C14H21 |
ABC2D14E21 |
-21.39 |
2.99 |
-8.98 |
-0.53 |
0 |
|
|
212982 |
81062442 |
2 |
ON2C6H11 |
AB2C6D11 |
-58.5 |
7.04 |
-9.25 |
0.16 |
0 |
|
|
212983 |
81062443 |
1 |
O2N4C11H20 |
A2B4C11D20 |
-55.06 |
5.49 |
-9.26 |
-0.04 |
0 |
|
|
212984 |
81062444 |
1 |
O2N4C13H24 |
A2B4C13D24 |
-71.59 |
5.53 |
-9.23 |
0.06 |
0 |
|
|
212985 |
81062445 |
1 |
N2O2C9H20 |
A2B2C9D20 |
-105.82 |
3.63 |
-9.2 |
1.02 |
0 |
|
|
212986 |
81062447 |
1 |
NO2C15H25 |
AB2C15D25 |
-91.47 |
2.32 |
-8.88 |
0.46 |
0 |
|
|
212987 |
81062448 |
1 |
ClNSO3C9H20 |
ABCD3E9F20 |
-159.87 |
4.3 |
-9.71 |
0.37 |
0 |
|
|
212988 |
81062450 |
1 |
NO4C15H23 |
AB4C15D23 |
-149.06 |
3.44 |
-8.66 |
0.09 |
0 |
|
|
212989 |
81062452 |
1 |
NO2C11H25 |
AB2C11D25 |
-125.97 |
2.93 |
-8.78 |
2.09 |
0 |
|
|
212990 |
81062453 |
1 |
NSO3C13H17 |
ABC3D13E17 |
-67.85 |
2.68 |
-9.12 |
-0.93 |
0 |
|
|
212991 |
81062454 |
1 |
NO2C12H27 |
AB2C12D27 |
-130.6 |
2.63 |
-8.62 |
2.09 |
0 |
|
|
212992 |
81062455 |
1 |
NO2C15H23 |
AB2C15D23 |
-81.56 |
2.36 |
-8.78 |
0.14 |
0 |
|
|
212993 |
81062456 |
1 |
NO3C16H27 |
AB3C16D27 |
-128.7 |
2.23 |
-8.7 |
0.28 |
0 |
|
|
212994 |
81062457 |
1 |
NO3C16H23 |
AB3C16D23 |
-96.53 |
2.09 |
-9.02 |
-0.36 |
0 |