Geometry & MOs

Info

ID:	234314
PubChem CID:	92298155
Reduced:	SN2O3C21H24 (1)
Stoich.:	AB2C3D21E24 (1)
Weight, g/mol:	270.113506
ΔH_f, kcal/mol:	-85.55
Dipole, Da:	2.72
IP(EA), eV:	-8.74(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(3-chlorophenoxy)-N-[2-(dimethylamino)ethyl]propanamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1=CC=CC=C1C(=O)N2CCOCC2)SCC3=CC=CC=C3

DOS

IR

Vibrations