Geometry & MOs

Info

ID:	350315
PubChem CID:	127277393
Reduced:	SN2O4C20H30 (1)
Stoich.:	AB2C4D20E30 (1)
Weight, g/mol:	289.167794
ΔH_f, kcal/mol:	-177.32
Dipole, Da:	3.2
IP(EA), eV:	-9.82(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyclohexyl-2-hydroxyethyl)-1,3-dihydro-2-benzofuran-5-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)C(CNC(=O)C2=CC=CC(=C2)CN3CCS(=O)(=O)CC3)O

DOS

IR

Vibrations