Geometry & MOs

Info

ID:	406151
PubChem CID:	135076721
Reduced:	NO2F5C21H22 (1)
Stoich.:	AB2C5D21E22 (1)
Weight, g/mol:	339.089384
ΔH_f, kcal/mol:	-289.01
Dipole, Da:	4.25
IP(EA), eV:	-8.65(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4,4-dimethyl-5-oxo-5-(2,3,4,5,6-pentafluoroanilino)pentanoate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)OCCCC(C)(C)C(=O)NC2=C(C(=C(C(=C2F)F)F)F)F

DOS

IR

Vibrations