Geometry & MOs

Info

ID:	368888
PubChem CID:	127330859
Reduced:	SO2N3C15H23 (1)
Stoich.:	AB2C3D15E23 (1)
Weight, g/mol:	321.151098
ΔH_f, kcal/mol:	-78.38
Dipole, Da:	3.13
IP(EA), eV:	-8.43(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]-7-oxabicyclo[2.2.1]heptane-2-carboxamide

Drug info:

PubChemData

Smile

C1CCN(C1)C2=NC(=CS2)CCNC(=O)C3CCCOC3

DOS

IR

Vibrations