List Systems
Back
Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
354085 |
127285889 |
1 |
ON5C15H19 |
AB5C15D19 |
52.72 |
3.49 |
-9.02 |
-0.97 |
0 |
|
|
354086 |
127285890 |
1 |
N2O3C14H20 |
A2B3C14D20 |
-126.61 |
6.49 |
-9.03 |
-0.78 |
0 |
|
|
354087 |
127285891 |
1 |
N2O2C13H24 |
A2B2C13D24 |
-112.32 |
4.08 |
-8.97 |
0.81 |
0 |
|
|
354088 |
127285892 |
2 |
NOC10H14 |
ABC10D14 |
-75.87 |
3.51 |
-9.24 |
0.11 |
0 |
|
|
354089 |
127285893 |
1 |
O2N3C12H17 |
A2B3C12D17 |
-50.12 |
2.89 |
-8.67 |
-0.25 |
0 |
|
|
354090 |
127285894 |
1 |
O2N3C14H19 |
A2B3C14D19 |
-58.98 |
6.0 |
-8.63 |
-0.73 |
0 |
|
|
354091 |
127285895 |
1 |
ON3C15H27 |
AB3C15D27 |
-58.99 |
3.71 |
-8.56 |
1.1 |
0 |
|
|
354092 |
127285896 |
1 |
ON3C13H23 |
AB3C13D23 |
-46.4 |
5.48 |
-8.83 |
0.98 |
0 |
|
|
354093 |
127285897 |
1 |
ON3C13H23 |
AB3C13D23 |
-27.84 |
5.13 |
-8.78 |
0.88 |
0 |
|
|
354094 |
127286024 |
1 |
O2N5C20H35 |
A2B5C20D35 |
-42.75 |
2.14 |
-8.41 |
-0.28 |
0 |
|
|
354095 |
127286025 |
1 |
O2N5C17H31 |
A2B5C17D31 |
-94.3 |
3.24 |
-8.34 |
-0.09 |
0 |
|
|
354096 |
127286027 |
1 |
ON6C16H22 |
AB6C16D22 |
46.47 |
4.86 |
-9.4 |
-1.04 |
0 |
|
|
354097 |
127286028 |
1 |
SN3O3C17H33 |
AB3C3D17E33 |
-150.05 |
6.52 |
-8.82 |
0.72 |
0 |
|
|
354098 |
127286029 |
1 |
SO3N4C17H32 |
AB3C4D17E32 |
-129.89 |
7.6 |
-8.92 |
0.82 |
0 |
|
|
354099 |
127286030 |
2 |
N3C8H12 |
A3B8C12 |
98.68 |
7.11 |
-8.78 |
-0.86 |
0 |
|
|
354100 |
127286031 |
1 |
N3O3C22H33 |
A3B3C22D33 |
-109.2 |
5.21 |
-8.69 |
0.06 |
0 |
|
|
354101 |
127286032 |
1 |
N2C13H26 |
A2B13C26 |
-21.0 |
1.2 |
-8.41 |
2.79 |
0 |
|
|
354102 |
127286033 |
4 |
NOC5H9 |
ABC5D9 |
-192.0 |
1.78 |
-8.65 |
0.62 |
0 |
|
|
354103 |
127286034 |
1 |
O2N4C17H30 |
A2B4C17D30 |
-97.88 |
2.43 |
-8.3 |
-0.03 |
0 |
|
|
354104 |
127286035 |
1 |
O3N4C15H24 |
A3B4C15D24 |
-89.06 |
3.13 |
-9.08 |
-0.46 |
0 |
|
|
354105 |
127286036 |
1 |
BrSO2N3C16H20 |
ABC2D3E16F20 |
-58.58 |
4.06 |
-8.46 |
-0.21 |
0 |
|
|
354106 |
127286037 |
1 |
SN2O5C16H28 |
AB2C5D16E28 |
-234.77 |
1.15 |
-8.81 |
0.53 |
0 |
|
|
354107 |
127286038 |
1 |
N3O3C13H21 |
A3B3C13D21 |
-77.19 |
0.94 |
-9.02 |
-0.4 |
0 |
|
|
354108 |
127286039 |
1 |
N3O3C19H33 |
A3B3C19D33 |
-167.13 |
3.11 |
-9.21 |
0.91 |
0 |
|
|
354109 |
127286040 |
3 |
NOC5H9 |
ABC5D9 |
-159.52 |
2.9 |
-9.21 |
0.77 |
0 |
|
|
354110 |
127286041 |
1 |
ON5C14H19 |
AB5C14D19 |
51.13 |
7.84 |
-8.95 |
-0.87 |
0 |
|
|
354111 |
127286042 |
1 |
O2N3C16H21 |
A2B3C16D21 |
-35.28 |
1.97 |
-8.68 |
-0.53 |
0 |
|
|
354112 |
127286043 |
1 |
SN2O4C19H34 |
AB2C4D19E34 |
-211.25 |
9.25 |
-9.06 |
0.77 |
0 |
|
|
354113 |
127286044 |
1 |
SO3N4C17H24 |
AB3C4D17E24 |
-110.51 |
4.1 |
-8.74 |
-0.34 |
0 |
|
|
354114 |
127286045 |
1 |
O4N5C16H21 |
A4B5C16D21 |
-83.37 |
5.71 |
-9.15 |
-0.38 |
0 |
|
|
354115 |
127286046 |
1 |
N4O4C21H26 |
A4B4C21D26 |
-157.56 |
4.29 |
-8.5 |
-0.29 |
0 |
|
|
354116 |
127286047 |
1 |
O3N5C20H21 |
A3B5C20D21 |
-48.99 |
7.87 |
-8.74 |
-0.83 |
0 |
|
|
354117 |
127286048 |
4 |
NOC5H8 |
ABC5D8 |
-194.86 |
5.7 |
-8.84 |
-0.2 |
0 |
|
|
354118 |
127286049 |
2 |
N2O2C9H14 |
A2B2C9D14 |
-185.42 |
3.52 |
-8.89 |
-0.2 |
0 |
|
|
354119 |
127286050 |
1 |
N4O4C19H30 |
A4B4C19D30 |
-188.35 |
7.24 |
-8.81 |
-0.28 |
0 |
|
|
354120 |
127286051 |
1 |
O4N6C17H24 |
A4B6C17D24 |
-130.36 |
6.68 |
-8.96 |
-0.36 |
0 |
|
|
354121 |
127286052 |
2 |
N2O2C9H14 |
A2B2C9D14 |
-186.31 |
4.82 |
-8.95 |
-0.17 |
0 |
|
|
354122 |
127286053 |
1 |
N4O4C19H30 |
A4B4C19D30 |
-189.48 |
6.3 |
-8.83 |
-0.21 |
0 |
|
|
354123 |
127286054 |
1 |
SO4N5C16H21 |
AB4C5D16E21 |
-134.85 |
8.97 |
-8.69 |
-0.65 |
0 |
|
|
354124 |
127286055 |
1 |
SN4O4C16H22 |
AB4C4D16E22 |
-160.64 |
5.78 |
-8.82 |
-0.24 |
0 |
|
|
354125 |
127286056 |
4 |
NOC5H8 |
ABC5D8 |
-193.0 |
8.35 |
-8.73 |
-0.27 |
0 |
|
|
354126 |
127286057 |
4 |
NOC5H8 |
ABC5D8 |
-204.02 |
5.1 |
-8.95 |
-0.21 |
0 |
|
|
354127 |
127286058 |
1 |
O4N5C18H25 |
A4B5C18D25 |
-130.99 |
8.67 |
-9.17 |
-0.31 |
0 |
|
|
354128 |
127286059 |
1 |
N5O5C16H23 |
A5B5C16D23 |
-209.14 |
5.05 |
-9.26 |
-0.32 |
0 |
|
|
354129 |
127286060 |
1 |
N4O4C19H30 |
A4B4C19D30 |
-196.95 |
4.34 |
-9.08 |
-0.27 |
0 |
|
|
354130 |
127286061 |
1 |
N5O5C18H27 |
A5B5C18D27 |
-216.06 |
1.93 |
-9.14 |
-0.29 |
0 |
|
|
354131 |
127286062 |
1 |
FN3O5C19H22 |
AB3C5D19E22 |
-231.42 |
3.32 |
-8.7 |
-0.41 |
0 |
|
|
354132 |
127286063 |
1 |
N4O4C19H30 |
A4B4C19D30 |
-194.43 |
4.47 |
-8.92 |
-0.16 |
0 |
|
|
354133 |
127286064 |
1 |
N4O5C17H26 |
A4B5C17D26 |
-224.08 |
5.29 |
-8.98 |
-0.21 |
0 |
|
|
354134 |
127286065 |
1 |
N4O4C21H26 |
A4B4C21D26 |
-148.4 |
6.71 |
-8.64 |
-0.26 |
0 |
|
|
354135 |
127286066 |
4 |
NOC5H8 |
ABC5D8 |
-205.52 |
4.45 |
-9.01 |
-0.22 |
0 |
|
|
354136 |
127286067 |
1 |
N4O4C19H30 |
A4B4C19D30 |
-195.58 |
4.86 |
-9.06 |
-0.29 |
0 |
|
|
354137 |
127286068 |
2 |
N2O2C9H14 |
A2B2C9D14 |
-187.17 |
6.27 |
-8.91 |
-0.21 |
0 |
|
|
354138 |
127286069 |
1 |
N4O5C18H28 |
A4B5C18D28 |
-226.53 |
3.14 |
-9.02 |
-0.23 |
0 |
|
|
354139 |
127286070 |
1 |
N4O4C19H30 |
A4B4C19D30 |
-193.68 |
6.33 |
-8.92 |
-0.24 |
0 |
|
|
354140 |
127286071 |
1 |
N4O4C21H26 |
A4B4C21D26 |
-150.93 |
1.92 |
-8.54 |
-0.23 |
0 |
|
|
354141 |
127286072 |
4 |
NOC5H8 |
ABC5D8 |
-193.83 |
3.83 |
-8.89 |
-0.14 |
0 |
|
|
354142 |
127286073 |
1 |
O4N5C17H23 |
A4B5C17D23 |
-88.99 |
2.01 |
-9.04 |
-0.29 |
0 |
|
|
354143 |
127286074 |
1 |
FO3N4C20H21 |
AB3C4D20E21 |
-123.41 |
4.69 |
-8.7 |
-0.96 |
0 |
|
|
354144 |
127286075 |
4 |
NOC4H6 |
ABC4D6 |
-152.75 |
3.89 |
-8.94 |
-0.18 |
0 |
|
|
354145 |
127286076 |
2 |
N2O2C8H11 |
A2B2C8D11 |
-147.58 |
1.45 |
-9.09 |
-0.13 |
0 |
|
|
354146 |
127286077 |
1 |
N5O5C18H27 |
A5B5C18D27 |
-216.76 |
7.68 |
-9.17 |
-0.3 |
0 |
|
|
354147 |
127286078 |
4 |
NOC4H6 |
ABC4D6 |
-178.15 |
4.83 |
-8.67 |
-0.08 |
0 |
|
|
354148 |
127286079 |
1 |
O3N5C15H21 |
A3B5C15D21 |
-84.26 |
1.7 |
-8.87 |
-0.12 |
0 |
|
|
354149 |
127286080 |
1 |
N3O3C22H25 |
A3B3C22D25 |
-92.19 |
2.99 |
-8.65 |
-0.37 |
0 |
|
|
354150 |
127286081 |
1 |
O3N6C17H24 |
A3B6C17D24 |
-64.84 |
9.74 |
-9.12 |
-0.19 |
0 |
|
|
354151 |
127286082 |
1 |
O3N6C17H24 |
A3B6C17D24 |
-65.22 |
6.05 |
-9.05 |
-0.22 |
0 |
|
|
354152 |
127286083 |
1 |
O3N6C16H24 |
A3B6C16D24 |
-91.28 |
6.18 |
-9.05 |
-0.23 |
0 |
|
|
354153 |
127286084 |
1 |
O3N6C17H26 |
A3B6C17D26 |
-96.92 |
3.18 |
-9.04 |
-0.22 |
0 |
|
|
354154 |
127286085 |
1 |
O3N6C16H24 |
A3B6C16D24 |
-94.37 |
7.06 |
-8.99 |
-0.22 |
0 |
|
|
354155 |
127286086 |
1 |
O4N5C16H23 |
A4B5C16D23 |
-132.84 |
6.64 |
-9.03 |
-0.25 |
0 |
|
|
354156 |
127286087 |
1 |
O3N6C20H26 |
A3B6C20D26 |
-70.25 |
5.12 |
-8.9 |
-0.45 |
0 |
|
|
354157 |
127286088 |
1 |
O3N6C19H24 |
A3B6C19D24 |
-65.4 |
4.68 |
-8.79 |
-0.39 |
0 |
|
|
354158 |
127286089 |
1 |
N3O5C19H23 |
A3B5C19D23 |
-176.68 |
5.36 |
-8.68 |
-0.18 |
0 |
|
|
354159 |
127286090 |
1 |
O4N5C16H23 |
A4B5C16D23 |
-130.92 |
7.46 |
-9.05 |
-0.29 |
0 |
|
|
354160 |
127286091 |
1 |
SO3N4C19H26 |
AB3C4D19E26 |
-109.85 |
2.72 |
-8.73 |
-0.37 |
0 |
|
|
354161 |
127286102 |
1 |
N4O4C15H22 |
A4B4C15D22 |
-156.26 |
6.91 |
-8.97 |
-0.29 |
0 |
|
|
354162 |
127286103 |
4 |
NOC4H6 |
ABC4D6 |
-159.49 |
4.98 |
-9.09 |
-0.27 |
0 |
|
|
354163 |
127286104 |
4 |
NOC5H8 |
ABC5D8 |
-204.26 |
5.05 |
-8.96 |
-0.23 |
0 |
|
|
354164 |
127286105 |
2 |
N2O2C9H13 |
A2B2C9D13 |
-154.03 |
5.67 |
-8.89 |
-0.21 |
0 |
|
|
354165 |
127286106 |
2 |
N2O2C9H10 |
A2B2C9D10 |
-111.14 |
2.41 |
-8.97 |
-0.52 |
0 |
|
|
354166 |
127286107 |
1 |
N4O5C18H28 |
A4B5C18D28 |
-228.41 |
5.14 |
-9.04 |
-0.31 |
0 |
|
|
354167 |
127286108 |
1 |
N3O3C16H29 |
A3B3C16D29 |
-149.34 |
4.16 |
-8.92 |
1.25 |
0 |
|
|
354168 |
127286109 |
1 |
O3N4C19H24 |
A3B4C19D24 |
-45.2 |
6.0 |
-9.06 |
-0.8 |
0 |
|
|
354169 |
127286110 |
1 |
O3N5C21H27 |
A3B5C21D27 |
-77.89 |
6.74 |
-8.72 |
-0.41 |
0 |
|
|
354170 |
127286111 |
1 |
O3N5C20H27 |
A3B5C20D27 |
-87.42 |
5.26 |
-8.79 |
-0.48 |
0 |
|
|
354171 |
127286112 |
1 |
SO2N4C18H24 |
AB2C4D18E24 |
-38.79 |
1.94 |
-8.7 |
-0.55 |
0 |
|
|
354172 |
127286113 |
1 |
FO2N4C20H21 |
AB2C4D20E21 |
-83.85 |
3.54 |
-8.68 |
-0.28 |
0 |
|
|
354173 |
127286114 |
1 |
ON5C22H23 |
AB5C22D23 |
48.06 |
2.9 |
-8.53 |
-0.32 |
0 |
|
|
354174 |
127286115 |
1 |
ON3C15H17 |
AB3C15D17 |
2.45 |
3.08 |
-8.67 |
0.05 |
0 |
|
|
354175 |
127286117 |
1 |
OF2N3C15H19 |
AB2C3D15E19 |
-113.29 |
2.64 |
-8.8 |
-0.52 |
0 |
|
|
354176 |
127286118 |
1 |
OF2N3C15H19 |
AB2C3D15E19 |
-117.75 |
6.31 |
-9.02 |
-0.3 |
0 |
|
|
354177 |
127286141 |
1 |
ON5C13H21 |
AB5C13D21 |
-5.83 |
2.11 |
-8.51 |
0.7 |
0 |
|
|
354178 |
127286142 |
1 |
OSN5C17H29 |
ABC5D17E29 |
-27.01 |
8.04 |
-8.87 |
-0.05 |
0 |
|
|
354179 |
127286143 |
1 |
O3N4C19H28 |
A3B4C19D28 |
-123.88 |
2.8 |
-8.18 |
0.02 |
0 |
|
|
354180 |
127286144 |
1 |
O3N4C20H26 |
A3B4C20D26 |
-124.96 |
6.44 |
-8.0 |
0.21 |
0 |
|
|
354181 |
127286145 |
1 |
O3N6C20H24 |
A3B6C20D24 |
-66.0 |
8.85 |
-8.18 |
-0.29 |
0 |
|
|
354182 |
127286146 |
1 |
O3N4C19H28 |
A3B4C19D28 |
-123.88 |
3.42 |
-8.51 |
0.22 |
0 |
|
|
354183 |
127286147 |
1 |
F2N3O3C17H21 |
A2B3C3D17E21 |
-207.51 |
7.93 |
-8.98 |
-0.49 |
0 |
|
|
354184 |
127286148 |
1 |
F2N3O3C16H19 |
A2B3C3D16E19 |
-202.47 |
6.88 |
-9.01 |
-0.54 |
0 |