Geometry & MOs

Info

ID:	404329
PubChem CID:	135065897
Reduced:	SiO5C31H34 (1)
Stoich.:	AB5C31D34 (1)
Weight, g/mol:	316.113316
ΔH_f, kcal/mol:	-116.57
Dipole, Da:	5.49
IP(EA), eV:	-7.93(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-oxo-7-phenylsulfanylbicyclo[3.2.0]hept-6-ene-1-carboxylate

Drug info:

PubChemData

Smile

CCOC(=C=C(C1=CC=CC=C1)[Si](C)(C)C)C2=C(OC3=C2C(=CC(=C3)OC)OC)C4=CC=C(C=C4)OC

DOS

IR

Vibrations