Geometry & MOs

Info

ID:	441337
PubChem CID:	135234198
Reduced:	OSN4C16H22 (1)
Stoich.:	ABC4D16E22 (1)
Weight, g/mol:	384.198383
ΔH_f, kcal/mol:	-3.96
Dipole, Da:	5.98
IP(EA), eV:	-8.62(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-(4-piperidin-4-ylphenyl)acetamide

Drug info:

PubChemData

Smile

CN=C(NC(=O)CC1=CC=CC=N1)SC(=N)C2CCCCC2

DOS

IR

Vibrations