Geometry & MOs

Info

ID:	149146
PubChem CID:	53788818
Reduced:	N3O5C33H55 (1)
Stoich.:	A3B5C33D55 (1)
Weight, g/mol:	476.174945
ΔH_f, kcal/mol:	-277.11
Dipole, Da:	4.79
IP(EA), eV:	-10.05(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-bis(1H-benzimidazol-2-yl)-5-naphthalen-2-yl-1H-benzimidazole

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCNC(=O)OCC(C1CCCC1)OC(=O)N(CC2=CC=CC=N2)C(=O)C

DOS

IR

Vibrations