Geometry & MOs

Info

ID:

49909

PubChem CID:

11534279

Reduced:

SF3N4O4H25C28 (1)

Stoich.:

AB3C4D4E25F28 (1)

Weight, g/mol:

570.091277

ΔHf, kcal/mol:

-230.09

Dipole, Da:

4.3

IP(EA), eV:

 -8.74(-1.49)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-(2-nitrooxyethyldisulfanyl)ethyl 6-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfinyl]benzimidazole-1-carboxylate

Drug info:

PubChemData

Smile

CCCN1C2=C(C=C(C=C2)SCCC3=CC=C(C=C3)C(=O)O)/C(=N\NC(=O)NC4=CC=CC(=C4)C(F)(F)F)/C1=O

DOS

IR

Vibrations