Geometry & MOs

Info

ID:

391506

PubChem CID:

135006044

Reduced:

NO2C13H19 (1)

Stoich.:

AB2C13D19 (1)

Weight, g/mol:

277.11365

ΔHf, kcal/mol:

-60.99

Dipole, Da:

4.73

IP(EA), eV:

-7.86(0.2)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(2R,3R)-3-ethenyl-2-methyl-4-methylidene-1-(4-methylphenyl)sulfonylpyrrolidine

Drug info:

PubChemData

Smile

CC[C@H]([C@H](C)C=O)NC1=CC=C(C=C1)OC

DOS

IR

Vibrations