(4As)-5-[(2,4-Diamino-6-Pteridinyl)Methyl]-4A,5-Dihydro-2H-Dibenzo[B,F]Azepin-8-Ol
Properties
Property | Value |
---|---|
Formula | C21H19N7O |
IUPAC Name | (10as,11r)-11-[(2,4-diaminopteridin-6-yl)methyl]-8,10a-dihydrobenzo[b][1]benzazepin-3-ol |
Molecular Mass | 385.422 g·mol−1 |
Heat of Formation | 451.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.46 ± 1.08 D |
Volume | 441.76 Å 3 |
Surface Area | 377.36 Å 2 |
HOMO Energy | -8.78 ± 0.55 eV |
LUMO Energy | 1.08 ± eV |
Point Group Symmetry | C1 |
InChIKey | PCBWLKUEKANDCL-INIZCTEOSA-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 |