Geometry & MOs

Info

ID:	219485
PubChem CID:	85148748
Reduced:	OPbC13H18 (1)
Stoich.:	ABC13D18 (1)
Weight, g/mol:	515.14363
ΔH_f, kcal/mol:	0.12
Dipole, Da:	4.11
IP(EA), eV:	-8.45(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(benzenesulfonylmethyl)-2-[1-(benzenesulfonyl)pyrrol-3-yl]-4,6-dimethyl-3a,4,5,6-tetrahydro-3H-cyclopenta[b]furan-6a-ol

Drug info:

PubChemData

Smile

CCCCC=C[Pb]C1=CC=C(C=C1)OC

DOS

IR

Vibrations