Geometry & MOs

Info

ID:	235289
PubChem CID:	92304355
Reduced:	ClON2C23H27 (1)
Stoich.:	ABC2D23E27 (1)
Weight, g/mol:	360.220164
ΔH_f, kcal/mol:	-23.07
Dipole, Da:	7.09
IP(EA), eV:	-8.34(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(1-methylindol-3-yl)-3-(4-methylphenyl)-1-piperidin-1-ylpropan-1-one

Drug info:

PubChemData

Smile

CCCCNC(=O)C[C@@H](C1=CC=C(C=C1)Cl)C2=CN(C3=CC=CC=C32)CC

DOS

IR

Vibrations