Geometry & MOs

Info

ID:	66089
PubChem CID:	46491065
Reduced:	ClO2N3C27H34 (1)
Stoich.:	AB2C3D27E34 (1)
Weight, g/mol:	377.173942
ΔH_f, kcal/mol:	-85.47
Dipole, Da:	4.44
IP(EA), eV:	-9.12(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethoxy-N-(1-pyridin-2-ylethyl)-4-(pyridin-4-ylmethoxy)benzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)C(=O)N2CCCC(C2)C(=O)NC3CCN(CC3)CC4=CC=C(C=C4)Cl)C

DOS

IR

Vibrations