Geometry & MOs

Info

ID:	141374
PubChem CID:	52870173
Reduced:	O2N5C24H31 (1)
Stoich.:	A2B5C24D31 (1)
Weight, g/mol:	361.236542
ΔH_f, kcal/mol:	-16.77
Dipole, Da:	8.16
IP(EA), eV:	-9.02(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[(2R,6R)-2,6-dimethylmorpholin-4-yl]methyl]-N-(3-methoxyphenyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CN(CC1=CC=CC=C1)C[C@H](CN2CCN(CC2)CC3=NC(=O)C4=CC=CC=C4N3)O

DOS

IR

Vibrations