| Formula |
C17H13BrN4O4 |
| IUPAC Name |
3-[(4-bromophenoxy)methyl]-n-(4-nitropyrazol-1-ium-2-id-1-yl)benzamide |
| Molecular Mass |
417.214 g·mol−1 |
| Heat of Formation |
203.1 ± 16.7 kJ·mol−1 |
| Dipole Moment |
7.42 ± 1.08 D |
| Volume |
413.29 Å 3 |
| Surface Area |
381.02 Å 2 |
| HOMO Energy |
-9.36 ± 0.55 eV |
| LUMO Energy |
-1.35 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 3-[(4-bromophenoxy)methyl]-n-(4-nitro-1-pyrazolyl)benzamide
- 3-[(4-bromophenoxy)methyl]-n-(4-nitropyrazol-1-yl)benzamide
- ak-968/41923327
|
| InChIKey |
XFINVNBTHCDDNO-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
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|
| Elements |
H
C
O
Br
N
|
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