2,6-Dimethyl-4-(2-Methyl-1,2-Dihydro-5H-Tetrazol-5-Ylidene)-2,5-Cyclohexadien-1-One
Properties
Property | Value |
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Formula | C10H12N4O |
IUPAC Name | 2,6-dimethyl-4-(2-methyltetrazole-1,2-diium-5-ylidene)cyclohexa-2,5-dien-1-one |
Molecular Mass | 204.228 g·mol−1 |
Heat of Formation | 276.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.64 ± 1.08 D |
Volume | 243.53 Å 3 |
Surface Area | 236.66 Å 2 |
HOMO Energy | -8.62 ± 0.55 eV |
LUMO Energy | -1.80 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | SYBBZSRVBRTILW-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |