Geometry & MOs

Info

ID:	251472
PubChem CID:	103104237
Reduced:	SO2N5C11H13 (1)
Stoich.:	AB2C5D11E13 (1)
Weight, g/mol:	311.049526
ΔH_f, kcal/mol:	-20.89
Dipole, Da:	6.71
IP(EA), eV:	-8.76(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N-(2-amino-2-oxoethyl)-6-chloro-N-ethyl-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C(=O)C1=C(C2=C(S1)N=NC=C2)N

DOS

IR

Vibrations