Geometry & MOs

Info

ID:	373138
PubChem CID:	131310565
Reduced:	N2O3C10H10 (1)
Stoich.:	A2B3C10D10 (1)
Weight, g/mol:	285.96631
ΔH_f, kcal/mol:	-74.53
Dipole, Da:	5.61
IP(EA), eV:	-9.34(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-5-ethoxy-2-methoxy-1-benzothiophene

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C(=C1)C(=O)N)C#N)O

DOS

IR

Vibrations