Geometry & MOs

Info

ID:	349003
PubChem CID:	127274729
Reduced:	O2N3C20H35 (1)
Stoich.:	A2B3C20D35 (1)
Weight, g/mol:	357.162332
ΔH_f, kcal/mol:	-136.78
Dipole, Da:	4.5
IP(EA), eV:	-8.82(0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-cyclopentylpiperazin-1-yl)-2-(2-pyrazin-2-yl-1,3-thiazol-4-yl)ethanone

Drug info:

PubChemData

Smile

CC(CC(=O)N1CCN(CC1)C2CCCC2)NC(=O)C3CCCCC3

DOS

IR

Vibrations