Geometry & MOs

Info

ID:	16113
PubChem CID:	459959
Reduced:	O3N4C28H36 (1)
Stoich.:	A3B4C28D36 (1)
Weight, g/mol:	476.278741
ΔH_f, kcal/mol:	-37.07
Dipole, Da:	4.1
IP(EA), eV:	-9.0(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(3-ethoxypropyl)-4-[5-[4-[N'-(3-ethoxypropyl)carbamimidoyl]phenyl]furan-2-yl]benzenecarboximidamide

Drug info:

PubChemData

Smile

CCOCCCN=C(C1=CC=C(C=C1)C2=CC=C(O2)C3=CC=C(C=C3)C(=NCCCOCC)N)N

DOS

IR

Vibrations