Geometry & MOs

Info

ID:	356244
PubChem CID:	127291317
Reduced:	FSN2O3C20H25 (1)
Stoich.:	ABC2D3E20F25 (1)
Weight, g/mol:	394.149718
ΔH_f, kcal/mol:	-164.12
Dipole, Da:	2.99
IP(EA), eV:	-9.16(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclopentyl-[4-[4-(1,3-thiazol-4-ylmethyl)piperazine-1-carbonyl]-1,3-thiazolidin-3-yl]methanone

Drug info:

PubChemData

Smile

C1CCC(C1)C(=O)N2CSCC2C(=O)NC3CCCOC4=C3C=C(C=C4)F

DOS

IR

Vibrations