Geometry & MOs

Info

ID:	76679
PubChem CID:	48425232
Reduced:	N2F3O4C18H23 (1)
Stoich.:	A2B3C4D18E23 (1)
Weight, g/mol:	387.140591
ΔH_f, kcal/mol:	-294.5
Dipole, Da:	1.24
IP(EA), eV:	-8.72(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(furan-2-yl)-1,2-oxazol-3-yl]-[4-[3-(2,2,2-trifluoroethoxy)propyl]piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CN(CCN1CCCOCC(F)(F)F)C(=O)C2=CC3=C(C=C2)OCCO3

DOS

IR

Vibrations