Geometry & MOs

Info

ID:	15968
PubChem CID:	456606
Reduced:	N4C12H13 (2)
Stoich.:	A4B12C13 (2)
Weight, g/mol:	426.228043
ΔH_f, kcal/mol:	122.44
Dipole, Da:	0.48
IP(EA), eV:	-9.01(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4,5-dihydro-1H-imidazol-2-yl)-2-[4-[6-(4,5-dihydro-1H-imidazol-2-yl)-1H-benzimidazol-2-yl]butyl]-1H-benzimidazole

Drug info:

PubChemData

Smile

C1CN=C(N1)C2=CC3=C(C=C2)N=C(N3)CCCCC4=NC5=C(N4)C=C(C=C5)C6=NCCN6

DOS

IR

Vibrations