Formula |
C22H22Br3N3O3 |
IUPAC Name |
3-[(3-bromo-4-methoxy-phenyl)methyl]-5-[3,5-dibromo-4-[3-(methylamino)propoxy]phenyl]-1h-pyrazin-2-one |
Molecular Mass |
616.140 g·mol−1 |
Heat of Formation |
-135.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.19 ± 1.08 D |
Volume |
556.88 Å 3 |
Surface Area |
482.85 Å 2 |
HOMO Energy |
-8.92 ± 0.55 eV |
LUMO Energy |
2.01 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 3-(3-bromo-4-methoxy-benzyl)-5-[3,5-dibromo-4-(3-methylaminopropoxy)phenyl]-1h-pyrazin-2-one
- 3-[(3-bromo-4-methoxy-phenyl)methyl]-5-[3,5-dibromo-4-(3-methylaminopropoxy)phenyl]-1h-pyrazin-2-one
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InChIKey |
NDGJXFQQCGZNIA-UHFFFAOYSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
C
O
Br
N
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