Geometry & MOs

Info

ID:	163268
PubChem CID:	57679376
Reduced:	O5N6C49H102 (1)
Stoich.:	A5B6C49D102 (1)
Weight, g/mol:	416.130697
ΔH_f, kcal/mol:	-379.28
Dipole, Da:	5.57
IP(EA), eV:	-8.82(1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[[2-(3,4-dimethylphenyl)-3H-benzimidazol-5-yl]sulfonyl]-2-methyl-1H-benzimidazole

Drug info:

PubChemData

Smile

COCCOCCOCCC(=O)NCCCCCCCCCCCCCCCCCCCCCCCC(=O)NCCCCCCC(CNCCCCN)CNCCCCN

DOS

IR

Vibrations