Geometry & MOs

Info

ID:	30604
PubChem CID:	841562
Reduced:	NCl2O2C13H15 (1)
Stoich.:	AB2C2D13E15 (1)
Weight, g/mol:	340.088164
ΔH_f, kcal/mol:	-90.73
Dipole, Da:	2.87
IP(EA), eV:	-9.41(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-ethoxy-4-hydroxyphenyl)methylideneamino]-1-benzothiophene-3-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)NC(=O)COC2=C(C=CC(=C2)Cl)Cl

DOS

IR

Vibrations