Geometry & MOs

Info

ID:	298309
PubChem CID:	117648279
Reduced:	SO2H10C11 (2)
Stoich.:	AB2C10D11 (2)
Weight, g/mol:	398.064651
ΔH_f, kcal/mol:	-89.95
Dipole, Da:	4.16
IP(EA), eV:	-9.08(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-methyl-4-(2-methylprop-2-enoylsulfanyl)phenyl] 4-prop-2-enoylsulfanylbenzoate

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)SC(=O)C(=C)C)OC(=O)C2=CC=C(C=C2)SC(=O)C(=C)C

DOS

IR

Vibrations