Geometry & MOs

Info

ID:	191098
PubChem CID:	78103564
Reduced:	INSeO2C15H16 (1)
Stoich.:	ABCD2E15F16 (1)
Weight, g/mol:	463.08979
ΔH_f, kcal/mol:	-56.69
Dipole, Da:	2.24
IP(EA), eV:	-9.01(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-[(2-methyl-1,3-dioxo-3a-phenylselanyl-4,5,6,6a-tetrahydrocyclopenta[c]pyrrol-5-yl)methyl]-2-oxocyclopentane-1-carboxylate

Drug info:

PubChemData

Smile

CN1C(=O)C2CC(CC2(C1=O)[Se]C3=CC=CC=C3)CI

DOS

IR

Vibrations