Geometry & MOs

Info

ID:	15595
PubChem CID:	445329
Reduced:	ON4C28H32 (1)
Stoich.:	AB4C28D32 (1)
Weight, g/mol:	440.257612
ΔH_f, kcal/mol:	45.24
Dipole, Da:	1.98
IP(EA), eV:	-8.8(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-cyclopentyl-4-[5-[4-(N'-cyclopentylcarbamimidoyl)phenyl]furan-2-yl]benzenecarboximidamide

Drug info:

PubChemData

Smile

C1CCC(C1)N=C(C2=CC=C(C=C2)C3=CC=C(O3)C4=CC=C(C=C4)C(=NC5CCCC5)N)N

DOS

IR

Vibrations