Geometry & MOs

Info

ID:	20293
PubChem CID:	582964
Reduced:	OC13H16 (1)
Stoich.:	AB13C16 (1)
Weight, g/mol:	188.120115
ΔH_f, kcal/mol:	-17.18
Dipole, Da:	3.14
IP(EA), eV:	-9.46(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-ethenylphenyl)-2,2-dimethylpropan-1-one

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)C1=CC=CC=C1C=C

DOS

IR

Vibrations