| Formula |
C7H5N5O |
| IUPAC Name |
2-amino-4-oxo-1,7-dihydropyrrolo[2,3-d]pyrimidine-5-carbonitrile |
| Molecular Mass |
175.147 g·mol−1 |
| Heat of Formation |
212.3 ± 16.7 kJ·mol−1 |
| Dipole Moment |
12.32 ± 1.08 D |
| Volume |
189.97 Å 3 |
| Surface Area |
190.85 Å 2 |
| HOMO Energy |
-9.39 ± 0.55 eV |
| LUMO Energy |
2.44 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 2-amino-4-keto-1,7-dihydropyrrolo[4,5-e]pyrimidine-5-carbonitrile
- 7-cyano-7-carbaguanine
- 7-cyano-7-deazaguanine
- pq0
|
| InChIKey |
FMKSMYDYKXQYRV-UHFFFAOYSA-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
|
| |
|
