Geometry & MOs

Info

ID:	389632
PubChem CID:	134994198
Reduced:	RuS3C16H26 (1)
Stoich.:	AB3C16D26 (1)
Weight, g/mol:	266.108899
ΔH_f, kcal/mol:	59.72
Dipole, Da:	17.26
IP(EA), eV:	-7.34(-3.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4-dimethyl-1-(4-nitrophenyl)iminothiane

Drug info:

PubChemData

Smile

CC1=C(C(=C(C(=C1C)C)C)C)C.C(CSCC[S-])[S-].[Ru+2]

DOS

IR

Vibrations