Geometry & MOs

Info

ID:	131454
PubChem CID:	51208538
Reduced:	N3O3H19C20 (1)
Stoich.:	A3B3C19D20 (1)
Weight, g/mol:	380.083078
ΔH_f, kcal/mol:	-15.8
Dipole, Da:	2.0
IP(EA), eV:	-9.1(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-carbamoylphenyl)-5-(2,3-dihydro-1,4-benzodioxin-6-yl)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=NO1)C2=CC=C(C=C2)OCC(=O)N3CCC4=CC=CC=C4C3

DOS

IR

Vibrations