Geometry & MOs

Info

ID:	138867
PubChem CID:	52436491
Reduced:	SN2O2C19H22 (1)
Stoich.:	AB2C2D19E22 (1)
Weight, g/mol:	312.183778
ΔH_f, kcal/mol:	-38.48
Dipole, Da:	7.16
IP(EA), eV:	-9.37(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S)-1-methyl-6-oxo-2-phenyl-N,N-bis(prop-2-enyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CN1[C@@H]([C@H](CCC1=O)C(=O)N(C)CC2=CC=CS2)C3=CC=CC=C3

DOS

IR

Vibrations