Formula |
C17H18Cl3NO3 |
IUPAC Name |
(3-chloro-5-hexyl-2,6-dihydroxy-phenyl)-(4,5-dichloropyrrol-1-ium-2-ylium-2-yl)methanone |
Molecular Mass |
390.689 g·mol−1 |
Heat of Formation |
-516.5 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.84 ± 1.08 D |
Volume |
432.85 Å 3 |
Surface Area |
387.02 Å 2 |
HOMO Energy |
-9.28 ± 0.55 eV |
LUMO Energy |
-0.81 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- (3-chloro-5-hexyl-2,6-dihydroxy-phenyl)-(4,5-dichloro-1h-pyrrol-2-yl)methanone
|
InChIKey |
VPAMZQVPJOAFJG-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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|
Elements |
H
C
N
O
Cl
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