Geometry & MOs

Info

ID:	145463
PubChem CID:	53528892
Reduced:	O2N5C17H23 (1)
Stoich.:	A2B5C17D23 (1)
Weight, g/mol:	335.085911
ΔH_f, kcal/mol:	-21.84
Dipole, Da:	3.2
IP(EA), eV:	-9.06(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(4-chlorophenyl)piperazin-1-yl]-2-(2-methyl-1,3-thiazol-4-yl)ethanone

Drug info:

PubChemData

Smile

CN(C)C(=O)CN1CCCN(CC1)C(=O)C2=CN3C=CC=CC3=N2

DOS

IR

Vibrations