Geometry & MOs

Info

ID:	368626
PubChem CID:	127329692
Reduced:	SN3O3C19H25 (1)
Stoich.:	AB3C3D19E25 (1)
Weight, g/mol:	313.146013
ΔH_f, kcal/mol:	-73.64
Dipole, Da:	7.23
IP(EA), eV:	-8.61(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4-cyclopentylpiperazin-1-yl)sulfonylmethyl]-5-methyl-1,2-oxazole

Drug info:

PubChemData

Smile

CC1=NC(=CO1)C2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C4CCCC4

DOS

IR

Vibrations