Geometry & MOs

Info

ID:	229294
PubChem CID:	87567348
Reduced:	SCl2O2C6H8 (1)
Stoich.:	AB2C2D6E8 (1)
Weight, g/mol:	273.053111
ΔH_f, kcal/mol:	-52.39
Dipole, Da:	4.51
IP(EA), eV:	-10.41(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-phosphono-1-pyrrolidin-1-ylpropyl)phosphonic acid

Drug info:

PubChemData

Smile

C=CC(S(=O)(=O)C(C=C)Cl)Cl

DOS

IR

Vibrations