Formula |
C8H10ClN5O2 |
IUPAC Name |
2-amino-7-[(2s)-3-chloro-2-hydroxy-propyl]-3h-purine-1,9-diium-5-id-6-one |
Molecular Mass |
243.650 g·mol−1 |
Heat of Formation |
-170.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.88 ± 1.08 D |
Volume |
260.72 Å 3 |
Surface Area |
239.48 Å 2 |
HOMO Energy |
-9.23 ± 0.55 eV |
LUMO Energy |
-0.73 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 2-amino-7-[(2s)-3-chloro-2-hydroxy-propyl]-3h-purin-6-one
- 2-amino-7-[(2s)-3-chloro-2-hydroxypropyl]-3h-purin-6-one
|
InChIKey |
PIDAKZXLZJQELO-SCSAIBSYSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
C
N
O
Cl
|
|
|