Geometry & MOs

Info

ID:	211663
PubChem CID:	81049278
Reduced:	NOSC12H15 (1)
Stoich.:	ABCD12E15 (1)
Weight, g/mol:	312.140469
ΔH_f, kcal/mol:	-10.61
Dipole, Da:	1.82
IP(EA), eV:	-8.07(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[2-amino-2-(2-chloro-4-fluoro-5-methylphenyl)ethyl]cyclopentyl]acetamide

Drug info:

PubChemData

Smile

CC1=C(SC2=C1C=C(C=C2)OC)CNC

DOS

IR

Vibrations