Geometry & MOs

Info

ID:	351611
PubChem CID:	127280503
Reduced:	O2N7C18H23 (1)
Stoich.:	A2B7C18D23 (1)
Weight, g/mol:	366.172562
ΔH_f, kcal/mol:	24.11
Dipole, Da:	4.54
IP(EA), eV:	-9.42(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-3-[3-oxo-3-[4-(2-pyrrolidin-1-ylacetyl)piperazin-1-yl]propyl]-1,3-thiazol-2-one

Drug info:

PubChemData

Smile

C1CCN(C1)CC(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)N4C=NN=N4

DOS

IR

Vibrations