Geometry & MOs

Info

ID:	207066
PubChem CID:	80341950
Reduced:	ClNO2H12C14 (1)
Stoich.:	ABC2D12E14 (1)
Weight, g/mol:	254.141913
ΔH_f, kcal/mol:	-33.08
Dipole, Da:	2.12
IP(EA), eV:	-9.61(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[methyl-[(4-methylphenyl)methyl]amino]pyridin-4-yl]ethanone

Drug info:

PubChemData

Smile

CC(=O)C1=CC(=NC=C1)OCC2=CC(=CC=C2)Cl

DOS

IR

Vibrations