Geometry & MOs

Info

ID:	156290
PubChem CID:	56369983
Reduced:	Cl2S2O3N4C19H24 (1)
Stoich.:	A2B2C3D4E19F24 (1)
Weight, g/mol:	386.214033
ΔH_f, kcal/mol:	-92.69
Dipole, Da:	6.05
IP(EA), eV:	-9.24(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-tert-butyl-1,3-thiazol-4-yl)methyl]-4-(2,3-dimethylphenyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=NC(=CS1)CNC(=O)N2CCN(CC2)S(=O)(=O)C3=C(C(=CC=C3)Cl)Cl

DOS

IR

Vibrations