Geometry & MOs

Info

ID:	165686
PubChem CID:	74583451
Reduced:	FN5C25H34 (1)
Stoich.:	AB5C25D34 (1)
Weight, g/mol:	348.212553
ΔH_f, kcal/mol:	31.47
Dipole, Da:	4.27
IP(EA), eV:	-8.59(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

9-[(2,3-difluorophenyl)methyl]-2-(1H-imidazol-1-ium-2-ylmethyl)-2-aza-9-azoniaspiro[4.5]decane

Drug info:

PubChemData

Smile

C1CC(CN(C1)CC2CNNC2C3=CC=CC=C3)N4CCN(CC4)C5=CC=CC=C5F

DOS

IR

Vibrations