Geometry & MOs

Info

ID:	290584
PubChem CID:	109756908
Reduced:	ION4C17H33 (1)
Stoich.:	ABC4D17E33 (1)
Weight, g/mol:	460.13352
ΔH_f, kcal/mol:	-41.37
Dipole, Da:	2.65
IP(EA), eV:	-8.63(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-3-(7-oxabicyclo[2.2.1]heptan-2-yl)-2-[(6-propan-2-yloxypyridin-3-yl)methyl]guanidine;hydroiodide

Drug info:

PubChemData

Smile

CC1CCCN(C1)C(C)CNC(=NC)NC2CC3CCC2O3.I

DOS

IR

Vibrations