Geometry & MOs

Info

ID:	285724
PubChem CID:	104122086
Reduced:	ClO2N3H14C15 (1)
Stoich.:	AB2C3D14E15 (1)
Weight, g/mol:	261.06689
ΔH_f, kcal/mol:	-49.46
Dipole, Da:	4.57
IP(EA), eV:	-8.9(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-6-methyl-N-(pyridin-4-ylmethyl)pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=N1)Cl)C(=O)NC2=CC=CC(=C2)NC(=O)C

DOS

IR

Vibrations