Geometry & MOs

Info

ID:	280727
PubChem CID:	103850981
Reduced:	NSO4C12H19 (1)
Stoich.:	ABC4D12E19 (1)
Weight, g/mol:	299.092436
ΔH_f, kcal/mol:	-150.04
Dipole, Da:	2.46
IP(EA), eV:	-8.97(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-(4-hydroxy-1-methoxybutan-2-yl)-2,3-dihydro-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

COCC(CCO)NC(=O)C1=CC=C(O1)CSC

DOS

IR

Vibrations