Geometry & MOs

Info

ID:

219601

PubChem CID:

85149432

Reduced:

ClFS2O4N5H24C27 (1)

Stoich.:

ABC2D4E5F24G27 (1)

Weight, g/mol:

602.15542

ΔHf, kcal/mol:

-72.06

Dipole, Da:

2.85

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.800126

Charge, e:

 0

Chem-info

IUPAC name:

[[N'-[1-(2-fluorophenyl)ethylideneamino]carbamimidoyl]sulfanyl-diphenylsilyl] N'-[1-(2-fluorophenyl)ethylideneamino]carbamimidothioate

Drug info:

PubChemData

Smile

CCCC[N+]1=C2C(=NC(=N2)CC3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(S4)Cl)C(=O)N(C1=O)CC5=CC=CC=C5F

DOS

IR

Vibrations