Geometry & MOs

Info

ID:	76518
PubChem CID:	48425032
Reduced:	N2F3O3C14H25 (1)
Stoich.:	A2B3C3D14E25 (1)
Weight, g/mol:	393.223926
ΔH_f, kcal/mol:	-306.98
Dipole, Da:	4.32
IP(EA), eV:	-8.78(0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-oxo-1-[4-[3-(2,2,2-trifluoroethoxy)propyl]piperazin-1-yl]propan-2-yl]cyclopentanecarboxamide

Drug info:

PubChemData

Smile

COCCCC(=O)N1CCN(CC1)CCCOCC(F)(F)F

DOS

IR

Vibrations