Geometry & MOs

Info

ID:	121557
PubChem CID:	50773220
Reduced:	N2O2C12H13 (2)
Stoich.:	A2B2C12D13 (2)
Weight, g/mol:	404.184841
ΔH_f, kcal/mol:	-65.04
Dipole, Da:	6.5
IP(EA), eV:	-8.4(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[N-(2-ethoxyphenyl)-N'-(pyridin-4-ylmethyl)carbamimidoyl]-3-methoxybenzamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)NC(=NCC2=CC=NC=C2)NC(=O)C3=CC(=CC(=C3)OC)OC

DOS

IR

Vibrations