Geometry & MOs

Info

ID:	23134
PubChem CID:	602314
Reduced:	ClSO6H13C15 (1)
Stoich.:	ABC6D13E15 (1)
Weight, g/mol:	356.012137
ΔH_f, kcal/mol:	-172.14
Dipole, Da:	5.07
IP(EA), eV:	-9.05(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-formyl-2,6-dimethoxyphenyl) 4-chlorobenzenesulfonate

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1OS(=O)(=O)C2=CC=C(C=C2)Cl)OC)C=O

DOS

IR

Vibrations