Geometry & MOs

Info

ID:	345659
PubChem CID:	127269959
Reduced:	NSO3C13H23 (1)
Stoich.:	ABC3D13E23 (1)
Weight, g/mol:	391.189592
ΔH_f, kcal/mol:	-156.45
Dipole, Da:	3.93
IP(EA), eV:	-9.8(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-adamantyl)-3-[5-(1-benzofuran-2-yl)-1,3,4-oxadiazol-2-yl]propanamide

Drug info:

PubChemData

Smile

CN(C1CCS(=O)(=O)C1)C(=O)C2CCCCCC2

DOS

IR

Vibrations