Geometry & MOs

Info

ID:	10106
PubChem CID:	97447
Reduced:	ClO2C12H13 (1)
Stoich.:	AB2C12D13 (1)
Weight, g/mol:	224.060407
ΔH_f, kcal/mol:	-85.41
Dipole, Da:	4.16
IP(EA), eV:	-9.73(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)cyclopentane-1-carboxylic acid

Drug info:

PubChemData

Smile

C1CCC(C1)(C2=CC=C(C=C2)Cl)C(=O)O

DOS

IR

Vibrations