Geometry & MOs

Info

ID:	172307
PubChem CID:	75494507
Reduced:	OS2N5H9C11 (1)
Stoich.:	AB2C5D9E11 (1)
Weight, g/mol:	468.99331
ΔH_f, kcal/mol:	88.7
Dipole, Da:	4.0
IP(EA), eV:	-9.31(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(3,4-dichlorophenyl)ethyl]-2-methyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]guanidine;hydroiodide

Drug info:

PubChemData

Smile

C1=CSC(=C1)C2=NC(=CS2)C(=O)NCC3=NNN=C3

DOS

IR

Vibrations