Geometry & MOs

Info

ID:	347291
PubChem CID:	127272085
Reduced:	SN3O3C19H29 (1)
Stoich.:	AB3C3D19E29 (1)
Weight, g/mol:	379.283492
ΔH_f, kcal/mol:	-118.97
Dipole, Da:	1.03
IP(EA), eV:	-8.83(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-[(2,6-dimethylmorpholin-4-yl)methyl]piperidin-1-yl]-2-oxoethyl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)CC2CCN(CC2)C(=O)CNC(=O)C3=CSC=C3

DOS

IR

Vibrations