Geometry & MOs

Info

ID:	143259
PubChem CID:	53174812
Reduced:	N2O2C15H18 (1)
Stoich.:	A2B2C15D18 (1)
Weight, g/mol:	446.142405
ΔH_f, kcal/mol:	-76.48
Dipole, Da:	6.25
IP(EA), eV:	-9.0(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentyl-5-[5-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylfuran-2-yl]-1,3,4-oxadiazole

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)C=C(C(=O)N2)CCC(=O)N(C)C

DOS

IR

Vibrations