Geometry & MOs

Info

ID:	29845
PubChem CID:	837721
Reduced:	NOCl2H13C15 (1)
Stoich.:	ABC2D13E15 (1)
Weight, g/mol:	287.098
ΔH_f, kcal/mol:	-21.5
Dipole, Da:	3.91
IP(EA), eV:	-9.15(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(3-methylsulfanylphenyl)-2-phenoxypropanamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)NC(=O)C2=CC(=C(C=C2)Cl)Cl

DOS

IR

Vibrations