Formula |
C20H25N7O6 |
IUPAC Name |
(2r)-2-[[4-[[(5r,6r)-2-amino-5-methyl-4-oxo-7,8-dihydro-6h-pteridin-1-ium-3-id-6-yl]methylamino]benzoyl]amino]pentanedioic acid |
Molecular Mass |
459.456 g·mol−1 |
Heat of Formation |
-827.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
9.78 ± 1.08 D |
Volume |
518.72 Å 3 |
Surface Area |
459.25 Å 2 |
HOMO Energy |
-8.23 ± 0.55 eV |
LUMO Energy |
2.71 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
ZNOVTXRBGFNYRX-CHWSQXEVSA-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
|
|
|