Geometry & MOs

Info

ID:	206
PubChem CID:	2309
Reduced:	NO4C16H21 (1)
Stoich.:	AB4C16D21 (1)
Weight, g/mol:	291.147058
ΔH_f, kcal/mol:	-130.01
Dipole, Da:	2.94
IP(EA), eV:	-9.01(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[7-[2-hydroxy-3-(propan-2-ylamino)propoxy]-1-benzofuran-2-yl]ethanone

Drug info:

PubChemData

Smile

CC(C)NCC(COC1=CC=CC2=C1OC(=C2)C(=O)C)O

DOS

IR

Vibrations