List Systems
Back
Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
333381 |
127251933 |
1 |
O3N5C25H31 |
A3B5C25D31 |
-90.65 |
3.36 |
-8.58 |
-0.41 |
0 |
|
|
333382 |
127251934 |
1 |
O3N5C23H29 |
A3B5C23D29 |
-81.02 |
8.26 |
-9.24 |
-0.33 |
0 |
|
|
333383 |
127251935 |
1 |
FSO2N5C20H26 |
ABC2D5E20F26 |
-76.39 |
4.98 |
-8.99 |
-0.55 |
0 |
|
|
333384 |
127251936 |
1 |
FSO3N5C21H26 |
ABC3D5E21F26 |
-127.14 |
6.61 |
-9.23 |
-0.54 |
0 |
|
|
333385 |
127251937 |
1 |
FSO3N5C21H26 |
ABC3D5E21F26 |
-122.91 |
9.9 |
-9.25 |
-0.92 |
0 |
|
|
333386 |
127251938 |
1 |
SO2N5C21H29 |
AB2C5D21E29 |
-37.89 |
2.98 |
-8.83 |
-0.2 |
0 |
|
|
333387 |
127251939 |
1 |
SO3N5C22H29 |
AB3C5D22E29 |
-88.46 |
8.28 |
-9.1 |
-0.22 |
0 |
|
|
333388 |
127251940 |
1 |
SO3N5C22H29 |
AB3C5D22E29 |
-83.71 |
5.49 |
-9.23 |
-0.57 |
0 |
|
|
333389 |
127251941 |
1 |
O2N5C23H31 |
A2B5C23D31 |
-41.98 |
8.92 |
-8.81 |
-0.25 |
0 |
|
|
333390 |
127251942 |
1 |
O2N6C25H32 |
A2B6C25D32 |
-17.34 |
6.24 |
-8.06 |
-0.15 |
0 |
|
|
333391 |
127251943 |
1 |
ON6C24H30 |
AB6C24D30 |
23.83 |
7.56 |
-8.29 |
-0.14 |
0 |
|
|
333392 |
127251944 |
1 |
O3N5C22H29 |
A3B5C22D29 |
-53.71 |
5.26 |
-8.42 |
-0.08 |
0 |
|
|
333393 |
127251945 |
1 |
O2N5C25H35 |
A2B5C25D35 |
-58.57 |
7.95 |
-8.26 |
-0.21 |
0 |
|
|
333394 |
127251946 |
1 |
O2N5C25H35 |
A2B5C25D35 |
-56.44 |
7.31 |
-8.5 |
-0.24 |
0 |
|
|
333395 |
127251947 |
1 |
FON5C24H32 |
ABC5D24E32 |
-57.45 |
6.46 |
-8.98 |
-0.13 |
0 |
|
|
333396 |
127251948 |
1 |
O3N5C24H33 |
A3B5C24D33 |
-91.23 |
7.0 |
-8.51 |
-0.2 |
0 |
|
|
333397 |
127251949 |
1 |
O3N5C24H33 |
A3B5C24D33 |
-86.16 |
8.28 |
-8.9 |
-0.24 |
0 |
|
|
333398 |
127251950 |
1 |
SO3N5C21H29 |
AB3C5D21E29 |
-78.69 |
11.08 |
-8.9 |
-0.42 |
0 |
|
|
333399 |
127251951 |
1 |
SO4N5C21H27 |
AB4C5D21E27 |
-109.99 |
3.05 |
-9.29 |
-0.46 |
0 |
|
|
333400 |
127251952 |
2 |
ON3C12H16 |
AB3C12D16 |
-27.32 |
9.43 |
-8.75 |
-0.28 |
0 |
|
|
333401 |
127251953 |
2 |
ON3C12H17 |
AB3C12D17 |
-33.82 |
9.3 |
-8.07 |
-0.28 |
0 |
|
|
333402 |
127251954 |
1 |
O2N5C26H35 |
A2B5C26D35 |
-39.93 |
5.33 |
-8.92 |
-0.13 |
0 |
|
|
333403 |
127251955 |
1 |
O2N5C25H33 |
A2B5C25D33 |
-42.13 |
6.43 |
-8.99 |
-0.15 |
0 |
|
|
333404 |
127251956 |
2 |
ON2C11H14 |
AB2C11D14 |
-50.22 |
4.52 |
-8.5 |
-0.26 |
0 |
|
|
333405 |
127251957 |
1 |
ON3C17H19 |
AB3C17D19 |
4.91 |
5.4 |
-9.22 |
-0.71 |
0 |
|
|
333406 |
127251958 |
1 |
ClO2N3C15H18 |
AB2C3D15E18 |
-24.92 |
0.92 |
-9.01 |
-0.19 |
0 |
|
|
333407 |
127251959 |
1 |
ClO2N3C15H18 |
AB2C3D15E18 |
-26.77 |
1.77 |
-8.98 |
-0.21 |
0 |
|
|
333408 |
127251960 |
1 |
ClO2N3C15H18 |
AB2C3D15E18 |
-26.72 |
3.14 |
-9.22 |
-0.28 |
0 |
|
|
333409 |
127251961 |
1 |
F2O2N3C15H17 |
A2B2C3D15E17 |
-109.12 |
2.1 |
-9.29 |
-0.45 |
0 |
|
|
333410 |
127251962 |
1 |
O2F3N3C16H18 |
A2B3C3D16E18 |
-182.0 |
2.64 |
-9.35 |
-0.46 |
0 |
|
|
333411 |
127251963 |
1 |
O2F3N3C16H18 |
A2B3C3D16E18 |
-179.3 |
2.95 |
-9.32 |
-0.66 |
0 |
|
|
333412 |
127251964 |
1 |
FON2H23C24 |
ABC2D23E24 |
-20.16 |
4.64 |
-9.42 |
-0.39 |
0 |
|
|
333413 |
127251965 |
1 |
FN3C23H24 |
AB3C23D24 |
25.22 |
4.39 |
-9.15 |
-0.25 |
0 |
|
|
333414 |
127251966 |
1 |
FN3C23H24 |
AB3C23D24 |
24.63 |
3.64 |
-9.13 |
-0.26 |
0 |
|
|
333415 |
127251967 |
1 |
ON3C24H27 |
AB3C24D27 |
33.74 |
1.67 |
-8.7 |
-0.06 |
0 |
|
|
333416 |
127251968 |
3 |
NC8H9 |
AB8C9 |
66.41 |
3.23 |
-9.05 |
-0.08 |
0 |
|
|
333417 |
127251969 |
1 |
FN3C23H24 |
AB3C23D24 |
25.78 |
3.92 |
-9.1 |
-0.24 |
0 |
|
|
333418 |
127251970 |
1 |
FN3C23H24 |
AB3C23D24 |
25.15 |
2.79 |
-9.07 |
-0.21 |
0 |
|
|
333419 |
127251971 |
1 |
ON3C24H27 |
AB3C24D27 |
34.74 |
1.73 |
-8.6 |
-0.13 |
0 |
|
|
333420 |
127251972 |
3 |
NC8H9 |
AB8C9 |
65.13 |
2.33 |
-8.99 |
-0.05 |
0 |
|
|
333421 |
127251973 |
1 |
FN3C23H24 |
AB3C23D24 |
24.5 |
3.42 |
-9.02 |
-0.17 |
0 |
|
|
333422 |
127251974 |
1 |
FN3C23H24 |
AB3C23D24 |
23.76 |
2.85 |
-9.03 |
-0.19 |
0 |
|
|
333423 |
127251975 |
1 |
ON3C24H27 |
AB3C24D27 |
33.32 |
1.4 |
-8.59 |
-0.09 |
0 |
|
|
333424 |
127251976 |
1 |
ClN3C23H24 |
AB3C23D24 |
62.41 |
1.61 |
-8.95 |
-0.16 |
0 |
|
|
333425 |
127251977 |
1 |
ON2C25H26 |
AB2C25D26 |
20.39 |
5.55 |
-9.12 |
0.1 |
0 |
|
|
333426 |
127251978 |
1 |
FON3H22C23 |
ABC3D22E23 |
-10.75 |
3.58 |
-9.65 |
-0.59 |
0 |
|
|
333427 |
127251979 |
1 |
O2N3C24H25 |
A2B3C24D25 |
-4.38 |
6.1 |
-8.75 |
-0.62 |
0 |
|
|
333428 |
127251980 |
1 |
ClON3H22C23 |
ABC3D22E23 |
27.65 |
4.39 |
-9.56 |
-0.52 |
0 |
|
|
333429 |
127251981 |
1 |
ON2C23H28 |
AB2C23D28 |
-10.48 |
2.01 |
-9.23 |
-0.15 |
0 |
|
|
333430 |
127251982 |
1 |
ON3C21H27 |
AB3C21D27 |
-2.68 |
2.96 |
-9.13 |
-0.05 |
0 |