Geometry & MOs

Info

ID:	156009
PubChem CID:	56368746
Reduced:	N3O3C23H23 (1)
Stoich.:	A3B3C23D23 (1)
Weight, g/mol:	431.09752
ΔH_f, kcal/mol:	-71.97
Dipole, Da:	6.2
IP(EA), eV:	-8.74(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-2-chloro-N-hexyl-N-(2-morpholin-4-ylethyl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCNC(=O)NC1=CC=CC(=C1)NC(=O)C2=C(C=CC(=C2)CC3=CC=CC=C3)O

DOS

IR

Vibrations