Geometry & MOs

Info

ID:	4756
PubChem CID:	11974
Reduced:	Br2O2N4C17H18 (1)
Stoich.:	A2B2C4D17E18 (1)
Weight, g/mol:	469.9776
ΔH_f, kcal/mol:	9.56
Dipole, Da:	4.16
IP(EA), eV:	-9.32(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-4-[3-(2-bromo-4-carbamimidoylphenoxy)propoxy]benzenecarboximidamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C(=N)N)Br)OCCCOC2=C(C=C(C=C2)C(=N)N)Br

DOS

IR

Vibrations