Geometry & MOs

Info

ID:	413842
PubChem CID:	135086792
Reduced:	ClO4C13H13 (1)
Stoich.:	AB4C13D13 (1)
Weight, g/mol:	290.00548
ΔH_f, kcal/mol:	-132.86
Dipole, Da:	6.35
IP(EA), eV:	-8.91(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(6-bromopyridin-3-yl)phenyl]acetamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)/C=C(/C(=O)CC(=O)OC)\Cl

DOS

IR

Vibrations