Geometry & MOs

Info

ID:	232056
PubChem CID:	87575317
Reduced:	O2F3N3H20C23 (1)
Stoich.:	A2B3C3D20E23 (1)
Weight, g/mol:	400.033268
ΔH_f, kcal/mol:	-164.05
Dipole, Da:	3.7
IP(EA), eV:	-9.39(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4,4,5,5,6,6,7,7,8,10,10,10-dodecafluoro-2-methyldec-2-enoic acid

Drug info:

PubChemData

Smile

C/C(=C/1\C(=O)N(C(C(=O)N1)(C)CC2=CC(=CC=C2)C(F)(F)F)C)/C3=CC=CC=C3C#N

DOS

IR

Vibrations