4,6-Dimethyl-2,3,4,12-Tetrahydro-1H-Pyrimido[1',6':1,2]Pyrido[3,4-B]Indol-5-Ium
Properties
Property | Value |
---|---|
Formula | C16H17N3 |
IUPAC Name | 4,6-dimethyl-2,3,4,12-tetrahydro-1h-pyrimido[1',6':1,2]pyrido[3,4-b]indol-5-ium |
Molecular Mass | 251.326 g·mol−1 |
Heat of Formation | 309.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.44 ± 1.08 D |
Volume | 305.51 Å 3 |
Surface Area | 274.33 Å 2 |
HOMO Energy | -7.55 ± 0.55 eV |
LUMO Energy | -0.79 ± eV |
Point Group Symmetry | C1 |
InChIKey | VBMLQDYYOPHOCB-NSHDSACASA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N |