9-Ethyl-6-Oxo-2,4,5,8-Tetrahydropyrido[2,3-E]Benzotriazole-1,3,3A,4,5,5A,7,8,9A,9B-Decaide-7-Carboxylic Acid
Properties
Property | Value |
---|---|
Formula | C12H21N4O3+ |
IUPAC Name | 9-ethyl-6-oxo-2,4,5,8-tetrahydropyrido[2,3-e]benzotriazole-1,3,3a,4,5,5a,7,8,9a,9b-decaide-7-carboxylic acid |
Molecular Mass | 269.320 g·mol−1 |
Heat of Formation | -119.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.29 ± 1.08 D |
Volume | 276.08 Å 3 |
Surface Area | 252.31 Å 2 |
HOMO Energy | -8.99 ± 0.55 eV |
LUMO Energy | 2.49 ± eV |
Point Group Symmetry | C1 |
InChIKey | QFPOINALRARPFK-UHFFFAOYSA-O |
QR Code | Generate QR Code |
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Elements | H C O N |