Geometry & MOs

Info

ID:	270957
PubChem CID:	103639003
Reduced:	BrNO2H14C16 (1)
Stoich.:	ABC2D14E16 (1)
Weight, g/mol:	271.02079
ΔH_f, kcal/mol:	-35.06
Dipole, Da:	4.41
IP(EA), eV:	-9.1(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-bromo-2-methylphenyl)-2-ethoxyacetamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1Br)NC(=O)C2=CC3=C(C=C2)OCC3

DOS

IR

Vibrations