Geometry & MOs

Info

ID:	401755
PubChem CID:	135052443
Reduced:	SN2O6C11H16 (1)
Stoich.:	AB2C6D11E16 (1)
Weight, g/mol:	207.049249
ΔH_f, kcal/mol:	-239.81
Dipole, Da:	5.15
IP(EA), eV:	-9.3(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

2-tert-butyl-1,3-benzodiphosphol-1-ide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(SC(=N1)C2C(C(C(O2)CO)O)O)N

DOS

IR

Vibrations