Geometry & MOs

Info

ID:	414102
PubChem CID:	135087056
Reduced:	SO4H14C15 (2)
Stoich.:	AB4C14D15 (2)
Weight, g/mol:	219.125929
ΔH_f, kcal/mol:	-232.28
Dipole, Da:	6.27
IP(EA), eV:	-9.08(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hydroxy-2,2,3-trimethyl-N-phenylbut-3-enamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)OC(C2=CC=CC=C2)C(C(=O)C3=CC=C(C=C3)OC)OS(=O)(=O)C4=CC=C(C=C4)C

DOS

IR

Vibrations