| Formula |
C14H20BrN4O12PS |
| IUPAC Name |
2-[n-(2-bromoethyl)-2,4-dinitro-6-(2-phosphonooxyethylcarbamoyl)anilino]ethyl methanesulfonate |
| Molecular Mass |
579.271 g·mol−1 |
| Heat of Formation |
-1730.5 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.16 ± 1.08 D |
| Volume |
546.95 Å 3 |
| Surface Area |
400.46 Å 2 |
| HOMO Energy |
-9.63 ± 0.55 eV |
| LUMO Energy |
1.13 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- methanesulfonic acid 2-[2-bromoethyl-[2,4-dinitro-6-(2-phosphonooxyethylcarbamoyl)phenyl]amino]ethyl ester
- methanesulfonic acid 2-[2-bromoethyl-[2,4-dinitro-6-[oxo-(2-phosphonooxyethylamino)methyl]phenyl]amino]ethyl ester
|
| InChIKey |
GZSOKPMDWVRVMG-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
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|
| DOI |
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| Downloads |
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|
| Elements |
C
H
O
N
P
S
Br
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