Formula |
C6H5BrN4 |
IUPAC Name |
5-bromopyrrolo[2,3-d]pyrimidin-7-ium-4-amine |
Molecular Mass |
213.035 g·mol−1 |
Heat of Formation |
246.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.34 ± 1.08 D |
Volume |
178.98 Å 3 |
Surface Area |
177.79 Å 2 |
HOMO Energy |
-8.80 ± 0.55 eV |
LUMO Energy |
2.51 ± eV |
Point Group Symmetry |
Cs
|
Synonyms
|
- (5-bromo-7h-pyrrolo[3,2-e]pyrimidin-4-yl)amine
- 5-bromo-7h-pyrrolo[3,2-e]pyrimidin-4-amine
|
CAS Number(s) |
|
InChIKey |
XBMGMUJNRRQVIR-UHFFFAOYSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
C
Br
N
|
|
|