Geometry & MOs

Info

ID:	76571
PubChem CID:	48425104
Reduced:	N2O2F3C15H25 (1)
Stoich.:	A2B2C3D15E25 (1)
Weight, g/mol:	405.223926
ΔH_f, kcal/mol:	-257.91
Dipole, Da:	1.78
IP(EA), eV:	-8.77(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC/C=C(/C)\C(=O)N1CCN(CC1)CCCOCC(F)(F)F

DOS

IR

Vibrations