Geometry & MOs

Info

ID:	235228
PubChem CID:	92304250
Reduced:	ON2C11H16 (1)
Stoich.:	AB2C11D16 (1)
Weight, g/mol:	374.235814
ΔH_f, kcal/mol:	-18.89
Dipole, Da:	1.94
IP(EA), eV:	-8.88(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-(1-ethylindol-3-yl)-3-(4-methylphenyl)-1-piperidin-1-ylpropan-1-one

Drug info:

PubChemData

Smile

CN1CC[C@H](C1)[C@@H](C2=CN=CC=C2)O

DOS

IR

Vibrations