Geometry & MOs

Info

ID:	23548
PubChem CID:	604564
Reduced:	OC14H18 (1)
Stoich.:	AB14C18 (1)
Weight, g/mol:	202.135765
ΔH_f, kcal/mol:	-57.78
Dipole, Da:	4.38
IP(EA), eV:	-9.07(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3,4,5,7-pentamethyl-2H-inden-1-one

Drug info:

PubChemData

Smile

CC1=CC(=C2C(=O)CC(C2=C1C)(C)C)C

DOS

IR

Vibrations