| Formula |
C13H12N4O3S |
| IUPAC Name |
[2-(allylamino)-4-amino-thiazol-5-yl]-(3-nitrophenyl)methanone |
| Molecular Mass |
304.324 g·mol−1 |
| Heat of Formation |
1998.6 ± 16.7 kJ·mol−1 |
| Dipole Moment |
7.72 ± 1.08 D |
| Volume |
309.12 Å 3 |
| Surface Area |
282.68 Å 2 |
| HOMO Energy |
-9.96 ± 0.55 eV |
| LUMO Energy |
-3.13 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 7n-730
- [2-(allylamino)-4-amino-5-thiazolyl]-(3-nitrophenyl)methanone
- [2-(allylamino)-4-amino-thiazol-5-yl]-(3-nitrophenyl)methanone
- [4-amino-2-(prop-2-enylamino)-1,3-thiazol-5-yl]-(3-nitrophenyl)methanone
- oprea1_001824
|
| InChIKey |
LDOOUPSIRAPDLT-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
| Elements |
S
C
O
N
|
| |
|
