Geometry & MOs

Info

ID:	233694
PubChem CID:	92092910
Reduced:	OCl2N3H17C20 (1)
Stoich.:	AB2C3D17E20 (1)
Weight, g/mol:	397.179027
ΔH_f, kcal/mol:	17.9
Dipole, Da:	3.3
IP(EA), eV:	-9.91(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-methoxynaphthalen-1-yl)-N-[(2-pyridin-4-ylpyridin-3-yl)methyl]propanamide

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)Cl)CCC(=O)NCC2=C(N=CC=C2)C3=CC=NC=C3)Cl

DOS

IR

Vibrations