Geometry & MOs

Info

ID:	367028
PubChem CID:	127322960
Reduced:	SO2N6C16H20 (1)
Stoich.:	AB2C6D16E20 (1)
Weight, g/mol:	391.167811
ΔH_f, kcal/mol:	33.73
Dipole, Da:	4.89
IP(EA), eV:	-8.8(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(2-imidazo[2,1-b][1,3]thiazol-6-ylacetyl)piperazin-1-yl]-1-morpholin-4-ylpropan-1-one

Drug info:

PubChemData

Smile

CCC1=NC(=NO1)CN2CCN(CC2)C(=O)CC3=CN4C=CSC4=N3

DOS

IR

Vibrations