Formula |
C16H18O3 |
IUPAC Name |
(5s,6s)-5-hydroxy-6-methoxy-5-[(z)-styryl]cyclohept-2-en-1-one |
Molecular Mass |
258.312 g·mol−1 |
Heat of Formation |
-327.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
1.87 ± 1.08 D |
Volume |
320.43 Å 3 |
Surface Area |
263.88 Å 2 |
HOMO Energy |
-9.51 ± 0.55 eV |
LUMO Energy |
-0.01 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (5s,6s)-5-hydroxy-6-methoxy-5-[(z)-2-phenylethenyl]cyclohept-2-en-1-one
- (5s,6s)-5-hydroxy-6-methoxy-5-[(z)-2-phenylvinyl]-1-cyclohept-2-enone
- (5s,6s)-5-hydroxy-6-methoxy-5-[(z)-2-phenylvinyl]cyclohept-2-en-1-one
|
InChIKey |
FLWCMQWIFOAMFR-VTBBSMOISA-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
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