Geometry & MOs

Info

ID:	158718
PubChem CID:	56465198
Reduced:	O2N4C27H32 (1)
Stoich.:	A2B4C27D32 (1)
Weight, g/mol:	484.169975
ΔH_f, kcal/mol:	-26.71
Dipole, Da:	3.5
IP(EA), eV:	-8.19(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(4-chlorophenoxy)methyl]-1,3-thiazol-4-yl]-N-[2-(4-methylpiperazin-1-yl)-1-phenylethyl]acetamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)CC(C2=CC=CC=C2)NC(=O)CCNC(=O)C3=CC4=CC=CC=C4C=C3

DOS

IR

Vibrations