Geometry & MOs

Info

ID:	344406
PubChem CID:	127267582
Reduced:	ON3C20H27 (1)
Stoich.:	AB3C20D27 (1)
Weight, g/mol:	375.161663
ΔH_f, kcal/mol:	7.62
Dipole, Da:	7.38
IP(EA), eV:	-9.09(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyanocyclohexyl)-3-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CCN(CC1=CC=C(C=C1)C(=O)NC2(CCCCC2)C#N)C3CC3

DOS

IR

Vibrations