Geometry & MOs

Info

ID:	385725
PubChem CID:	134979832
Reduced:	SiO3C33H44 (1)
Stoich.:	AB3C33D44 (1)
Weight, g/mol:	386.01879
ΔH_f, kcal/mol:	-159.99
Dipole, Da:	2.94
IP(EA), eV:	-8.9(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (1R,6R)-6-(4-chlorophenyl)selanyl-6-formyl-4-methylcyclohex-3-ene-1-carboxylate

Drug info:

PubChemData

Smile

C[C@H]1CC=C2C=CC[C@@H]([C@@H]2[C@H]1CO[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C(C)(C)C)OC(=O)C(C)(C)C

DOS

IR

Vibrations