Geometry & MOs

Info

ID:	285848
PubChem CID:	104133980
Reduced:	ClON2C15H21 (1)
Stoich.:	ABC2D15E21 (1)
Weight, g/mol:	302.118591
ΔH_f, kcal/mol:	-25.67
Dipole, Da:	4.69
IP(EA), eV:	-9.67(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-6-ethyl-N-[1-(4-methylphenyl)ethyl]pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=NC(=CC(=C1)C(=O)N(C)CC2CC2)Cl

DOS

IR

Vibrations