| Formula |
C12H11N5 |
| IUPAC Name |
3-benzylpurin-3-ium-4-ylium-6-amine |
| Molecular Mass |
225.249 g·mol−1 |
| Heat of Formation |
416.2 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.61 ± 1.08 D |
| Volume |
264.09 Å 3 |
| Surface Area |
244.44 Å 2 |
| HOMO Energy |
-8.74 ± 0.55 eV |
| LUMO Energy |
2.10 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 3-(phenylmethyl)-6-purinamine
- 3-(phenylmethyl)purin-6-amine
- 3-bzade
- 3h-purin-6-amine, 3-(phenylmethyl)-
- [3-(benzyl)purin-6-yl]amine
- ab-323/13887461
- adenine, 3-benzyl-
- oprea1_165750
|
| CAS Number(s) |
|
| InChIKey |
ZRRXJVVXTVXDII-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
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|
| Elements |
H
C
N
|
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