Geometry & MOs

Info

ID:	409089
PubChem CID:	135081864
Reduced:	NSbS2Cl6C14H20 (1)
Stoich.:	ABC2D6E14F20 (1)
Weight, g/mol:	217.981984
ΔH_f, kcal/mol:	-94.51
Dipole, Da:	16.42
IP(EA), eV:	-10.01(-3.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-methyl-2-oxa-1lambda4,8-dithia-3,7-diazabicyclo[3.3.0]octa-1(5),3,6-triene-6-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC2=[S+]SN=C2C(=C1)C(C)(C)C.Cl[Sb-](Cl)(Cl)(Cl)(Cl)Cl

DOS

IR

Vibrations