Geometry & MOs

Info

ID:	290580
PubChem CID:	109756682
Reduced:	ClION5C19H25 (1)
Stoich.:	ABCD5E19F25 (1)
Weight, g/mol:	489.04285
ΔH_f, kcal/mol:	32.35
Dipole, Da:	7.86
IP(EA), eV:	-8.86(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-methyl-3-(7-oxabicyclo[2.2.1]heptan-2-yl)guanidine;hydroiodide

Drug info:

PubChemData

Smile

CCNC(=NCC1=CN(N=C1)C2=CC=C(C=C2)Cl)NC3CC4CCC3O4.I

DOS

IR

Vibrations