Geometry & MOs

Info

ID:	121556
PubChem CID:	50773219
Reduced:	FON4C23H23 (1)
Stoich.:	ABC4D23E23 (1)
Weight, g/mol:	434.195405
ΔH_f, kcal/mol:	-0.48
Dipole, Da:	4.41
IP(EA), eV:	-8.96(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[N-(4-ethoxyphenyl)-N'-(pyridin-4-ylmethyl)carbamimidoyl]-3,5-dimethoxybenzamide

Drug info:

PubChemData

Smile

CC(C)C1=CC(=CC=C1)NC(=NCC2=CC=NC=C2)NC(=O)C3=CC(=CC=C3)F

DOS

IR

Vibrations