Geometry & MOs

Info

ID:	42958
PubChem CID:	10317406
Reduced:	SO3H20C23 (1)
Stoich.:	AB3C20D23 (1)
Weight, g/mol:	376.174202
ΔH_f, kcal/mol:	-39.25
Dipole, Da:	6.27
IP(EA), eV:	-9.61(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-dodec-1-en-6-yloxy-2-ethoxycarbothioylsulfanylacetate

Drug info:

PubChemData

Smile

CC1=C(CC(O1)(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

DOS

IR

Vibrations