Geometry & MOs

Info

ID:	56336
PubChem CID:	17425125
Reduced:	ClN2O5C19H19 (1)
Stoich.:	AB2C5D19E19 (1)
Weight, g/mol:	320.098391
ΔH_f, kcal/mol:	-159.93
Dipole, Da:	9.45
IP(EA), eV:	-9.3(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methoxyethylcarbamoyl)-2-[4-(trifluoromethyl)phenoxy]acetamide

Drug info:

PubChemData

Smile

COCCNC(=O)NC(=O)COC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Cl

DOS

IR

Vibrations