Geometry & MOs

Info

ID:	285865
PubChem CID:	104134088
Reduced:	ClON2C17H19 (1)
Stoich.:	ABC2D17E19 (1)
Weight, g/mol:	282.149891
ΔH_f, kcal/mol:	-14.8
Dipole, Da:	5.27
IP(EA), eV:	-9.56(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-hexyl-6-propylpyridine-4-carboxamide

Drug info:

PubChemData

Smile

CCC1=NC(=CC(=C1)C(=O)NCC(C)C2=CC=CC=C2)Cl

DOS

IR

Vibrations