Geometry & MOs

Info

ID:	222493
PubChem CID:	85300916
Reduced:	SO6C16H24 (1)
Stoich.:	AB6C16D24 (1)
Weight, g/mol:	344.10823
ΔH_f, kcal/mol:	-267.95
Dipole, Da:	6.77
IP(EA), eV:	-10.29(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(benzenesulfonyl)-4-(4-methoxyphenyl)cyclohex-2-en-1-ol

Drug info:

PubChemData

Smile

CCOC(=O)C(C(CC(C)C)OS(=O)(=O)C1=CC=C(C=C1)C)O

DOS

IR

Vibrations