Geometry & MOs

Info

ID:	242670
PubChem CID:	97857822
Reduced:	NSO2C17H19 (1)
Stoich.:	ABC2D17E19 (1)
Weight, g/mol:	311.115758
ΔH_f, kcal/mol:	-31.88
Dipole, Da:	3.29
IP(EA), eV:	-8.89(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(SC=C1)[C@@H]2C[C@H]2C(=O)N[C@@H](CO)C3=CC=CC=C3

DOS

IR

Vibrations