Geometry & MOs

Info

ID:	393276
PubChem CID:	135019922
Reduced:	NSSiO7C23H35 (1)
Stoich.:	ABCD7E23F35 (1)
Weight, g/mol:	340.09806
ΔH_f, kcal/mol:	-347.35
Dipole, Da:	9.77
IP(EA), eV:	-8.47(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (Z)-7-(4-methylphenyl)sulfonyloxy-3-oxooct-6-enoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=O)N([C@@H]2CO[Si](C)(C)C(C)(C)C)C(=O)OC(C)(C)C

DOS

IR

Vibrations