Geometry & MOs

Info

ID:	139326
PubChem CID:	52511031
Reduced:	SN2O3C19H24 (1)
Stoich.:	AB2C3D19E24 (1)
Weight, g/mol:	360.150764
ΔH_f, kcal/mol:	-81.81
Dipole, Da:	4.69
IP(EA), eV:	-8.54(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-N-[[(3S)-3-morpholin-4-ylthiolan-3-yl]methyl]-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)OC(=C2)C(=O)NC[C@@]3(CCSC3)N4CCOCC4

DOS

IR

Vibrations