Geometry & MOs

Info

ID:	11042
PubChem CID:	110189
Reduced:	OC6H8 (2)
Stoich.:	AB6C8 (2)
Weight, g/mol:	192.11503
ΔH_f, kcal/mol:	-83.42
Dipole, Da:	4.83
IP(EA), eV:	-9.8(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-ethylphenyl)-2-hydroxy-2-methylpropan-1-one

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)C(=O)C(C)(C)O

DOS

IR

Vibrations