Geometry & MOs

Info

ID:	201540
PubChem CID:	79553452
Reduced:	NO3C15H25 (1)
Stoich.:	AB3C15D25 (1)
Weight, g/mol:	293.119798
ΔH_f, kcal/mol:	-163.06
Dipole, Da:	4.82
IP(EA), eV:	-9.53(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(thiadiazole-4-carbonyl)piperidin-2-yl]cyclohexan-1-one

Drug info:

PubChemData

Smile

CC(=O)CC1CCCCCN1C(=O)CC2CCCO2

DOS

IR

Vibrations