Geometry & MOs

Info

ID:	32056
PubChem CID:	4254759
Reduced:	S2N4O4H18C23 (1)
Stoich.:	A2B4C4D18E23 (1)
Weight, g/mol:	410.150954
ΔH_f, kcal/mol:	-4.08
Dipole, Da:	5.54
IP(EA), eV:	-8.32(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-(2,3-dimethylphenyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NN=C(S3)NC4=CC=C(C=C4)OC5=CC=CC=C5

DOS

IR

Vibrations