Geometry & MOs

Info

ID:	347437
PubChem CID:	127272286
Reduced:	NOC9H13 (2)
Stoich.:	ABC9D13 (2)
Weight, g/mol:	339.252192
ΔH_f, kcal/mol:	-103.29
Dipole, Da:	2.85
IP(EA), eV:	-9.44(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1CCC(CC1)NC(=O)N[C@@H]2[C@@H](CC3=CC=CC=C23)O

DOS

IR

Vibrations