Geometry & MOs

Info

ID:	290943
PubChem CID:	111644111
Reduced:	IN3O3C15H32 (1)
Stoich.:	AB3C3D15E32 (1)
Weight, g/mol:	552.13642
ΔH_f, kcal/mol:	-136.24
Dipole, Da:	3.44
IP(EA), eV:	-9.62(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[2-[[N-ethyl-N'-[3-(oxan-4-ylmethoxy)propyl]carbamimidoyl]amino]ethyl]benzamide;hydroiodide

Drug info:

PubChemData

Smile

CN=C(NCCCOC)NCCCOCC1CCOCC1.I

DOS

IR

Vibrations