Geometry & MOs

Info

ID:	294052
PubChem CID:	117425427
Reduced:	ClO3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	268.086622
ΔH_f, kcal/mol:	-134.16
Dipole, Da:	6.61
IP(EA), eV:	-9.34(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[5-chloro-2-(methoxymethyl)phenyl]cyclopentane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC(C)C1=CC(=C(C=C1Cl)C2(CCC2)C(=O)O)O

DOS

IR

Vibrations