Geometry & MOs

Info

ID:	220868
PubChem CID:	85240225
Reduced:	ClO3C15H17 (1)
Stoich.:	AB3C15D17 (1)
Weight, g/mol:	280.086622
ΔH_f, kcal/mol:	-139.37
Dipole, Da:	4.99
IP(EA), eV:	-9.83(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(3-chlorobenzoyl)cyclopentane-1-carboxylate

Drug info:

PubChemData

Smile

CC1=CC2=C(CC(C2O)(C)C)C3=C1C(OC3=O)CCl

DOS

IR

Vibrations