Geometry & MOs

Info

ID:	242671
PubChem CID:	97857826
Reduced:	NO4H17C18 (1)
Stoich.:	AB4C17D18 (1)
Weight, g/mol:	311.115758
ΔH_f, kcal/mol:	-89.18
Dipole, Da:	4.21
IP(EA), eV:	-8.88(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-2-hydroxy-1-phenylethyl]-7-methoxy-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=CC2=C1OC(=C2)C(=O)N[C@@H](CO)C3=CC=CC=C3

DOS

IR

Vibrations