Formula |
C17H17Cl2NO |
IUPAC Name |
(2r,4r)-4-(3,4-dichlorophenyl)-7-methoxy-2-methyl-3,4-dihydro-1h-isoquinoline |
Molecular Mass |
322.229 g·mol−1 |
Heat of Formation |
-42.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.20 ± 1.08 D |
Volume |
366.67 Å 3 |
Surface Area |
324.99 Å 2 |
HOMO Energy |
-8.84 ± 0.55 eV |
LUMO Energy |
-0.51 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- pdsp1_001613
- pdsp2_001597
|
InChIKey |
ZJDCGVDEEHWEIG-OAHLLOKOSA-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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