Geometry & MOs

Info

ID:	50922
PubChem CID:	12013516
Reduced:	O3C12H16 (1)
Stoich.:	A3B12C16 (1)
Weight, g/mol:	254.13068
ΔH_f, kcal/mol:	-118.1
Dipole, Da:	3.72
IP(EA), eV:	-8.94(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-hydroxy-3-methyl-4-(4-phenylphenyl)butan-2-one

Drug info:

PubChemData

Smile

CC(C(C1=CC=C(C=C1)OC)O)C(=O)C

DOS

IR

Vibrations