6-Methyltetrazolo(1,5-C)Pyrimidine-5,7(6H,8H)-Dione
Properties
Property | Value |
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Formula | C5H5N5O2 |
IUPAC Name | 3-methyl-3,7,8-triaza-1-azonia-9-azanidabicyclo[4.3.0]nona-1(6),7-diene-2,4-dione |
Molecular Mass | 167.125 g·mol−1 |
Heat of Formation | 19.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.90 ± 1.08 D |
Volume | 173.2 Å 3 |
Surface Area | 172.51 Å 2 |
HOMO Energy | -11.25 ± 0.55 eV |
LUMO Energy | -1.52 ± eV |
Point Group Symmetry | Cs |
Synonyms |
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CAS Number(s) |
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InChIKey | ROYGNZVFFMFZAC-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 |