Geometry & MOs

Info

ID:	339564
PubChem CID:	127261554
Reduced:	ON4C13H20 (1)
Stoich.:	AB4C13D20 (1)
Weight, g/mol:	384.252526
ΔH_f, kcal/mol:	-21.1
Dipole, Da:	6.25
IP(EA), eV:	-9.09(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(hexanoylamino)-6-pyridin-2-yl-1H-pyridin-2-yl]hexanamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=N)N)NC(=O)CCCCCN

DOS

IR

Vibrations