Geometry & MOs

Info

ID:	29805
PubChem CID:	837448
Reduced:	N3O3C13H15 (1)
Stoich.:	A3B3C13D15 (1)
Weight, g/mol:	269.141579
ΔH_f, kcal/mol:	-102.3
Dipole, Da:	4.77
IP(EA), eV:	-9.7(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(2-methylphenoxy)-N-(3-methylphenyl)propanamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(NC(=O)N[C@H]1C2=CC=NC=C2)C

DOS

IR

Vibrations