Geometry & MOs

Info

ID:	138475
PubChem CID:	52370750
Reduced:	ClON3C20H22 (1)
Stoich.:	ABC3D20E22 (1)
Weight, g/mol:	286.204513
ΔH_f, kcal/mol:	28.43
Dipole, Da:	1.82
IP(EA), eV:	-8.69(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,3-dihydroindol-1-yl)-3-[(3R,5R)-3,5-dimethylpiperidin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

C1CN(CCN1CN2[C@@H](CC2=O)C3=CC=CC=C3)C4=CC=CC=C4Cl

DOS

IR

Vibrations