Geometry & MOs

Info

ID:	140740
PubChem CID:	52750535
Reduced:	ClN2O4C19H21 (1)
Stoich.:	AB2C4D19E21 (1)
Weight, g/mol:	421.07601
ΔH_f, kcal/mol:	-150.61
Dipole, Da:	8.28
IP(EA), eV:	-8.72(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(2,4-dichlorophenoxy)-N-[[3-fluoro-4-(2-methylimidazol-1-yl)phenyl]methyl]propanamide

Drug info:

PubChemData

Smile

CC(C)COC(=O)NC1=CC=CC(=C1)NC(=O)C2=C(C=CC(=C2)Cl)OC

DOS

IR

Vibrations