Geometry & MOs

Info

ID:	158628
PubChem CID:	56464340
Reduced:	O3N7C22H23 (1)
Stoich.:	A3B7C22D23 (1)
Weight, g/mol:	434.154325
ΔH_f, kcal/mol:	14.67
Dipole, Da:	5.97
IP(EA), eV:	-9.46(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl]-4-methyl-2-(2-methylpropyl)-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

C1CC(=O)N(C1)CCC(=O)NNC(=O)C2=CC=C(C=C2)CN3N=C(N=N3)C4=CC=CC=C4

DOS

IR

Vibrations