Geometry & MOs

Info

ID:	137489
PubChem CID:	52213871
Reduced:	SN2O3H16C17 (1)
Stoich.:	AB2C3D16E17 (1)
Weight, g/mol:	277.123342
ΔH_f, kcal/mol:	-54.2
Dipole, Da:	2.23
IP(EA), eV:	-9.9(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-1-(3-chlorophenyl)ethyl]-2-[(1R)-cyclopent-2-en-1-yl]-N-methylacetamide

Drug info:

PubChemData

Smile

CS(=O)(=O)CC1=CC(=CC=C1)C(=O)NCC2=CC(=CC=C2)C#N

DOS

IR

Vibrations