Geometry & MOs

Info

ID:	20857
PubChem CID:	586169
Reduced:	OC7H10 (2)
Stoich.:	AB7C10 (2)
Weight, g/mol:	220.14633
ΔH_f, kcal/mol:	-77.99
Dipole, Da:	3.47
IP(EA), eV:	-8.74(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(3,5-dimethylfuran-2-yl)-6-methylhept-3-en-2-one

Drug info:

PubChemData

Smile

CC1=CC(=C(O1)C(C)(C)CC=CC(=O)C)C

DOS

IR

Vibrations