Geometry & MOs

Info

ID:	352102
PubChem CID:	127283170
Reduced:	ClN3O3C19H28 (1)
Stoich.:	AB3C3D19E28 (1)
Weight, g/mol:	348.252526
ΔH_f, kcal/mol:	-123.13
Dipole, Da:	3.83
IP(EA), eV:	-8.93(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-N-(3-propan-2-ylcyclohexyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1(COCCN1CCNC(=O)N2CCOC(C2)C3=CC=CC=C3Cl)C

DOS

IR

Vibrations