2,6-Diamino-3,4-Dimethylisochromeno[7,8-D]Imidazol-7(3H)-One
Properties
Property | Value |
---|---|
Formula | C12H12N4O2 |
IUPAC Name | 2,6-diamino-3,4-dimethyl-pyrano[3,4-e]benzimidazol-7-one |
Molecular Mass | 244.249 g·mol−1 |
Heat of Formation | 1123.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.69 ± 1.08 D |
Volume | 276.48 Å 3 |
Surface Area | 261.02 Å 2 |
HOMO Energy | -9.64 ± 0.55 eV |
LUMO Energy | -0.95 ± eV |
Point Group Symmetry | C1 |
InChIKey | IYPSSTXPOKBOPU-UHFFFAOYSA-O |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
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Elements | C O N |