Formula |
C22H23N3O3 |
IUPAC Name |
(3s)-1-(1,3-benzodioxol-5-ylmethyl)-3-(4-imidazol-1-ylphenoxy)piperidine |
Molecular Mass |
377.436 g·mol−1 |
Heat of Formation |
-57.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.86 ± 1.08 D |
Volume |
451.26 Å 3 |
Surface Area |
393.72 Å 2 |
HOMO Energy |
-8.83 ± 0.55 eV |
LUMO Energy |
2.68 ± eV |
Point Group Symmetry |
C1
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Synonyms
|
- (3s)-1-(1,3-benzodioxol-5-ylmethyl)-3-(4-imidazol-1-ylphenoxy)piperidine
- (3s)-1-(1,3-benzodioxol-5-ylmethyl)-3-[4-(1-imidazolyl)phenoxy]piperidine
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InChIKey |
HHOPJGKEAIIIDF-FQEVSTJZSA-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
O
N
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