Geometry & MOs

Info

ID:	199288
PubChem CID:	79226662
Reduced:	NO2C13H19 (1)
Stoich.:	AB2C13D19 (1)
Weight, g/mol:	270.107836
ΔH_f, kcal/mol:	-72.71
Dipole, Da:	2.1
IP(EA), eV:	-8.87(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-ethylphenoxy)methyl]-2,3-dihydro-1-benzothiophene

Drug info:

PubChemData

Smile

CCC(CO)NCC1COC2=CC=CC=C12

DOS

IR

Vibrations