Geometry & MOs

Info

ID:	20107
PubChem CID:	579407
Reduced:	NO2F8H11C17 (1)
Stoich.:	AB2C8D11E17 (1)
Weight, g/mol:	413.066204
ΔH_f, kcal/mol:	-440.39
Dipole, Da:	6.78
IP(EA), eV:	-9.28(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-fluoro-N-[2-(2,2,3,3-tetrafluoropropoxy)-5-(trifluoromethyl)phenyl]benzamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)F)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)OCC(C(F)F)(F)F

DOS

IR

Vibrations