Geometry & MOs

Info

ID:	25412
PubChem CID:	624435
Reduced:	O3H16C18 (1)
Stoich.:	A3B16C18 (1)
Weight, g/mol:	443.057925
ΔH_f, kcal/mol:	-55.85
Dipole, Da:	4.15
IP(EA), eV:	-7.92(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[3-(2,2,3,3,3-pentafluoropropanoylamino)propyl]phenyl] 2,2,3,3,3-pentafluoropropanoate

Drug info:

PubChemData

Smile

CC1=C2C=C(C=CC2=CC3=C1C=CC(=C3C=O)OC)OC

DOS

IR

Vibrations