Geometry & MOs

Info

ID:	341760
PubChem CID:	127264453
Reduced:	O3N6C25H34 (1)
Stoich.:	A3B6C25D34 (1)
Weight, g/mol:	710.289306
ΔH_f, kcal/mol:	-57.92
Dipole, Da:	5.63
IP(EA), eV:	-8.58(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[2-[3-[(3-carboxy-4-phenylphenyl)methyl]-7-methyl-2-propylbenzimidazol-5-yl]benzimidazol-1-yl]methyl]-2-phenylbenzoic acid

Drug info:

PubChemData

Smile

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)C(=O)CN4CC(NC(C4)C)C)OCC)C

DOS

IR

Vibrations