Geometry & MOs

Info

ID:	389457
PubChem CID:	134993048
Reduced:	ClOC11H13 (1)
Stoich.:	ABC11D13 (1)
Weight, g/mol:	305.039165
ΔH_f, kcal/mol:	-28.19
Dipole, Da:	2.52
IP(EA), eV:	-9.61(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-oxo-3-phenylpropyl)sulfonylethanesulfonamide

Drug info:

PubChemData

Smile

C[C@@H](/C=C\Cl)[C@@H](C1=CC=CC=C1)O

DOS

IR

Vibrations