Geometry & MOs

Info

ID:	15487
PubChem CID:	442497
Reduced:	OC5H7 (2)
Stoich.:	AB5C7 (2)
Weight, g/mol:	166.09938
ΔH_f, kcal/mol:	-25.0
Dipole, Da:	5.87
IP(EA), eV:	-9.54(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,6S)-6-methyl-3-propan-2-ylidene-7-oxabicyclo[4.1.0]heptan-2-one

Drug info:

PubChemData

Smile

CC(=C1CC[C@]2([C@@H](C1=O)O2)C)C

DOS

IR

Vibrations