Geometry & MOs

Info

ID:	285864
PubChem CID:	104134084
Reduced:	OCl2N2H14C15 (1)
Stoich.:	AB2C2D14E15 (1)
Weight, g/mol:	302.118591
ΔH_f, kcal/mol:	-15.0
Dipole, Da:	2.78
IP(EA), eV:	-9.72(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-6-ethyl-N-(2-phenylpropyl)pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CCC1=NC(=CC(=C1)C(=O)NCC2=CC(=CC=C2)Cl)Cl

DOS

IR

Vibrations