Geometry & MOs

Info

ID:	372506
PubChem CID:	131298924
Reduced:	NSO2C11H13 (1)
Stoich.:	ABC2D11E13 (1)
Weight, g/mol:	223.0667
ΔH_f, kcal/mol:	-49.76
Dipole, Da:	2.18
IP(EA), eV:	-7.95(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-1-(3-methoxy-1-benzothiophen-2-yl)ethanol

Drug info:

PubChemData

Smile

COC1=CC=CC2=C1SC(=C2O)CCN

DOS

IR

Vibrations