Geometry & MOs

Info

ID:	2082
PubChem CID:	5748
Reduced:	BrNO3C21H34 (1)
Stoich.:	ABC3D21E34 (1)
Weight, g/mol:	427.17221
ΔH_f, kcal/mol:	-143.79
Dipole, Da:	14.42
IP(EA), eV:	-7.8(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-cyclohexyl-2-hydroxy-2-phenylacetyl)oxyethyl-diethyl-methylazanium;bromide

Drug info:

PubChemData

Smile

CC[N+](C)(CC)CCOC(=O)C(C1CCCCC1)(C2=CC=CC=C2)O.[Br-]

DOS

IR

Vibrations