Geometry & MOs

Info

ID:	232839
PubChem CID:	87577185
Reduced:	SO6C11H22 (1)
Stoich.:	AB6C11D22 (1)
Weight, g/mol:	532.11283
ΔH_f, kcal/mol:	-286.27
Dipole, Da:	2.06
IP(EA), eV:	-9.04(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[4-[bromo-[(2-chloro-6-methylphenyl)methyl]carbamoyl]spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetate

Drug info:

PubChemData

Smile

C(CCO[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)CCS

DOS

IR

Vibrations