Formula |
C21H18N4O2 |
IUPAC Name |
[3-(2-hydroxy-3-pyrrolo[3,2-c]pyridin-1-ium-3a-id-2-yl-phenyl)phenyl]methylurea |
Molecular Mass |
358.393 g·mol−1 |
Heat of Formation |
20.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.60 ± 1.08 D |
Volume |
417.19 Å 3 |
Surface Area |
378.91 Å 2 |
HOMO Energy |
-8.60 ± 0.55 eV |
LUMO Energy |
2.15 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 7nh
- [3-[2-hydroxy-3-(1h-pyrrolo[4,5-c]pyridin-2-yl)phenyl]benzyl]urea
- [3-[2-hydroxy-3-(1h-pyrrolo[4,5-c]pyridin-2-yl)phenyl]phenyl]methylurea
|
InChIKey |
SRPOHNDQBDHONJ-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
|
|
|