Geometry & MOs

Info

ID:	2292
PubChem CID:	6646
Reduced:	BrNO3C17H24 (1)
Stoich.:	ABC3D17E24 (1)
Weight, g/mol:	369.09396
ΔH_f, kcal/mol:	-118.33
Dipole, Da:	12.78
IP(EA), eV:	-7.88(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl) 2-hydroxy-2-phenylacetate;bromide

Drug info:

PubChemData

Smile

C[N+]1(C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)O)C.[Br-]

DOS

IR

Vibrations