Geometry & MOs

Info

ID:	313192
PubChem CID:	126612471
Reduced:	FO2N3C24H24 (1)
Stoich.:	AB2C3D24E24 (1)
Weight, g/mol:	484.067331
ΔH_f, kcal/mol:	-67.0
Dipole, Da:	2.0
IP(EA), eV:	-8.92(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7-methyl-3-bicyclo[3.3.1]nonanyl) 2-[2,4-bis(fluorosulfonyloxy)phenoxy]acetate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)N2CCC(CCC2=O)CC3=NC=C(C=C3)N4C=CC=CC4=O)F

DOS

IR

Vibrations