Geometry & MOs

Info

ID:	226262
PubChem CID:	87350256
Reduced:	N4O5H12C18 (1)
Stoich.:	A4B5C12D18 (1)
Weight, g/mol:	395.06332
ΔH_f, kcal/mol:	-87.79
Dipole, Da:	6.34
IP(EA), eV:	-9.69(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-bromopyridin-2-yl)-N-[4-(2-methylpyridin-4-yl)phenyl]propanamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)OC(=O)N2CC3=CC(=NC=C3)NC(=O)C4=CN=CO4

DOS

IR

Vibrations