Geometry & MOs

Info

ID:	367715
PubChem CID:	127325665
Reduced:	OSN6C15H26 (1)
Stoich.:	ABC6D15E26 (1)
Weight, g/mol:	391.319878
ΔH_f, kcal/mol:	38.14
Dipole, Da:	2.69
IP(EA), eV:	-8.65(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-cyclohexylacetyl)amino]-N-methyl-N-[(1-methylpiperidin-3-yl)methyl]cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)N(C)CC1CCCN(C1)C)SC2=NN=NN2C3CC3

DOS

IR

Vibrations