Geometry & MOs

Info

ID:	62276
PubChem CID:	26718878
Reduced:	N2O5C17H18 (1)
Stoich.:	A2B5C17D18 (1)
Weight, g/mol:	357.022642
ΔH_f, kcal/mol:	-169.78
Dipole, Da:	1.66
IP(EA), eV:	-8.48(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-5-yl)-5-(4-chlorophenyl)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCC1=C(C(=C(N1)C(=O)NC2=CC3=C(C=C2)OCO3)C)C(=O)OC

DOS

IR

Vibrations