2,7-Dimethyl-6-[(1-Propyn-1-Ylamino)Methyl]-4(1H)-Quinazolinone
Properties
Property | Value |
---|---|
Formula | C14H15N3O |
IUPAC Name | 2,7-dimethyl-6-[(prop-1-ynylamino)methyl]-3h-quinazolin-1-ium-4a-id-4-one |
Molecular Mass | 241.288 g·mol−1 |
Heat of Formation | 129.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 1.85 ± 1.08 D |
Volume | 296.53 Å 3 |
Surface Area | 285.04 Å 2 |
HOMO Energy | -8.61 ± 0.55 eV |
LUMO Energy | 2.27 ± eV |
Point Group Symmetry | C1 |
InChIKey | VHJQNTIPWBTKDM-UHFFFAOYSA-O |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
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Elements | H C O N |