Geometry & MOs

Info

ID:	26868
PubChem CID:	800521
Reduced:	NF2O3H9C12 (1)
Stoich.:	AB2C3D9E12 (1)
Weight, g/mol:	251.107692
ΔH_f, kcal/mol:	-187.56
Dipole, Da:	8.62
IP(EA), eV:	-9.8(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1-(4-chlorophenyl)ethyl]cyclopentanecarboxamide

Drug info:

PubChemData

Smile

CCN1C=C(C(=O)C2=CC(=C(C=C21)F)F)C(=O)O

DOS

IR

Vibrations