Geometry & MOs

Info

ID:	347567
PubChem CID:	127272422
Reduced:	ON4C20H28 (1)
Stoich.:	AB4C20D28 (1)
Weight, g/mol:	394.294391
ΔH_f, kcal/mol:	-16.58
Dipole, Da:	4.94
IP(EA), eV:	-8.48(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclohexylcarbamoyl)-2-[4-[(2,6-dimethylmorpholin-4-yl)methyl]piperidin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1(CCCCC1)C#N)N2CCC(C2)NC3=CC=CC=C3

DOS

IR

Vibrations