Geometry & MOs

Info

ID:	349482
PubChem CID:	127275269
Reduced:	ClON3H20C21 (1)
Stoich.:	ABC3D20E21 (1)
Weight, g/mol:	386.150954
ΔH_f, kcal/mol:	22.37
Dipole, Da:	6.01
IP(EA), eV:	-9.17(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-3-[1-[1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethyl]piperidin-4-yl]-1,3-dihydroindol-2-one

Drug info:

PubChemData

Smile

C1CN(CCC1C2C3=C(C=C(C=C3)Cl)NC2=O)CC4=CC=C(C=C4)C#N

DOS

IR

Vibrations