Geometry & MOs

Info

ID:	140242
PubChem CID:	52669590
Reduced:	ClNO3H20C21 (1)
Stoich.:	ABC3D20E21 (1)
Weight, g/mol:	369.113171
ΔH_f, kcal/mol:	-65.82
Dipole, Da:	2.82
IP(EA), eV:	-8.99(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(4-chloro-3-methylphenoxy)-N-[(R)-furan-2-yl(phenyl)methyl]propanamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)O[C@H](C)C(=O)N[C@@H](C2=CC=CC=C2)C3=CC=CO3)Cl

DOS

IR

Vibrations