Geometry & MOs

Info

ID:	211702
PubChem CID:	81049929
Reduced:	ON2C18H28 (1)
Stoich.:	AB2C18D28 (1)
Weight, g/mol:	286.204513
ΔH_f, kcal/mol:	-56.65
Dipole, Da:	4.99
IP(EA), eV:	-8.83(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methyl-2,3-dihydroindol-1-yl)-3-piperidin-3-ylbutan-1-one

Drug info:

PubChemData

Smile

CCN(C1=CC=CC=C1C)C(=O)CC(C)C2CCCNC2

DOS

IR

Vibrations