Geometry & MOs

Info

ID:	444400
PubChem CID:	135262312
Reduced:	NO2F3C18H22 (1)
Stoich.:	AB2C3D18E22 (1)
Weight, g/mol:	369.191564
ΔH_f, kcal/mol:	-227.95
Dipole, Da:	3.51
IP(EA), eV:	-9.31(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

spiro[11-azatricyclo[7.4.1.05,14]tetradeca-5,7,9(14)-triene-4,1'-cyclohexane];2,2,2-trifluoroacetic acid

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C(CC13CC3)CC(N)OC(=O)C(F)(F)F)C

DOS

IR

Vibrations