Geometry & MOs

Info

ID:	127048
PubChem CID:	50988424
Reduced:	SCl2N3C12H17 (1)
Stoich.:	AB2C3D12E17 (1)
Weight, g/mol:	250.087291
ΔH_f, kcal/mol:	-18.24
Dipole, Da:	4.78
IP(EA), eV:	-9.46(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-3-piperidin-4-yl-1,3-dihydroindol-2-one

Drug info:

PubChemData

Smile

C1=CC(=CN=C1)C2=CSC(=N2)CCCCN.Cl.Cl

DOS

IR

Vibrations