Geometry & MOs

Info

ID:	9068
PubChem CID:	85805
Reduced:	ClO2C11H11 (1)
Stoich.:	AB2C11D11 (1)
Weight, g/mol:	210.044757
ΔH_f, kcal/mol:	-79.0
Dipole, Da:	4.74
IP(EA), eV:	-9.79(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-3-methyl-5-phenyloxolan-2-one

Drug info:

PubChemData

Smile

CC1(CC(OC1=O)C2=CC=CC=C2)Cl

DOS

IR

Vibrations