Geometry & MOs

Info

ID:	127715
PubChem CID:	51012634
Reduced:	O3C11H18 (1)
Stoich.:	A3B11C18 (1)
Weight, g/mol:	503.01636
ΔH_f, kcal/mol:	-153.93
Dipole, Da:	2.59
IP(EA), eV:	-9.81(0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R,2R,4S)-1-(diethylsulfamoylmethyl)-7,7-dimethyl-2-bicyclo[2.2.1]heptanyl] 2,3-dibromopropanoate

Drug info:

PubChemData

Smile

CC1CC([C@]2(CCC[C@]1(O2)O)O)C=C

DOS

IR

Vibrations