Geometry & MOs

Info

ID:	16206
PubChem CID:	461565
Reduced:	F2O4N6C25H36 (1)
Stoich.:	A2B4C6D25E36 (1)
Weight, g/mol:	522.27661
ΔH_f, kcal/mol:	-207.06
Dipole, Da:	5.75
IP(EA), eV:	-9.12(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[5-(4-carbamimidoylphenoxy)pentoxy]benzenecarboximidamide;2,5-diamino-2-(difluoromethyl)pentanoic acid

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=N)N)OCCCCCOC2=CC=C(C=C2)C(=N)N.C(CC(C(F)F)(C(=O)O)N)CN

DOS

IR

Vibrations