Geometry & MOs

Info

ID:	391868
PubChem CID:	135010390
Reduced:	OSiC15H28 (1)
Stoich.:	ABC15D28 (1)
Weight, g/mol:	524.138091
ΔH_f, kcal/mol:	-88.79
Dipole, Da:	3.02
IP(EA), eV:	-8.8(1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[2-(benzenecarbonothioylamino)naphthalen-1-yl]naphthalen-2-yl]benzenecarbothioamide

Drug info:

PubChemData

Smile

C[Si](C)(C)C/C(=C/[C@H]1CCCC[C@@H]1C=C)/CO

DOS

IR

Vibrations