Geometry & MOs

Info

ID:	122946
PubChem CID:	50828067
Reduced:	SO3N5C23H25 (1)
Stoich.:	AB3C5D23E25 (1)
Weight, g/mol:	479.172417
ΔH_f, kcal/mol:	8.01
Dipole, Da:	10.51
IP(EA), eV:	-8.25(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-chlorophenyl)-[4-[3-(4-piperidin-1-ylphenyl)-1,2,4-oxadiazole-5-carbonyl]piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=CC=C(C=C2)C3=NOC(=N3)C(=O)N4CCN(CC4)C(=O)C5=CSC=C5

DOS

IR

Vibrations