Geometry & MOs

Info

ID:	57762
PubChem CID:	24277098
Reduced:	OSN3C10H19 (1)
Stoich.:	ABC3D10E19 (1)
Weight, g/mol:	227.145619
ΔH_f, kcal/mol:	-48.68
Dipole, Da:	2.4
IP(EA), eV:	-8.65(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-piperazin-1-ylcyclohexane-1-carbothioamide

Drug info:

PubChemData

Smile

CC(=O)N1CCN(CC1)C(C)(C)C(=S)N

DOS

IR

Vibrations