Geometry & MOs

Info

ID:	160484
PubChem CID:	57309832
Reduced:	ON2Si2C20H32 (1)
Stoich.:	AB2C2D20E32 (1)
Weight, g/mol:	269.073805
ΔH_f, kcal/mol:	-92.23
Dipole, Da:	7.76
IP(EA), eV:	-8.5(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R)-3-(3,4-dichlorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OCCC1=C(NC2=C1C=C(C=C2)C#N)[Si](C)(C)C

DOS

IR

Vibrations