Geometry & MOs

Info

ID:	365701
PubChem CID:	127318426
Reduced:	SN3O3C16H17 (1)
Stoich.:	AB3C3D16E17 (1)
Weight, g/mol:	336.150764
ΔH_f, kcal/mol:	-16.26
Dipole, Da:	2.65
IP(EA), eV:	-8.93(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-7-oxabicyclo[2.2.1]heptane-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)OC(=N2)SCC3=NOC(=N3)C4CCOCC4

DOS

IR

Vibrations