Geometry & MOs

Info

ID:	365748
PubChem CID:	127318473
Reduced:	ClN2O3C21H29 (1)
Stoich.:	AB2C3D21E29 (1)
Weight, g/mol:	265.142641
ΔH_f, kcal/mol:	-124.56
Dipole, Da:	1.52
IP(EA), eV:	-9.16(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(5-ethyl-1,2,4-oxadiazol-3-yl)ethyl]-7-oxabicyclo[2.2.1]heptane-2-carboxamide

Drug info:

PubChemData

Smile

CC1(CN(CCO1)C(CNC(=O)C2CC3CCC2O3)C4=CC=C(C=C4)Cl)C

DOS

IR

Vibrations