Geometry & MOs

Info

ID:	196172
PubChem CID:	78793151
Reduced:	FN3O3C25H26 (1)
Stoich.:	AB3C3D25E26 (1)
Weight, g/mol:	423.161663
ΔH_f, kcal/mol:	-105.34
Dipole, Da:	6.43
IP(EA), eV:	-8.13(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethoxyphenyl)-4-[[2-[methyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]amino]benzamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NCC(=O)N(C)CC3=CC=C(C=C3)F

DOS

IR

Vibrations