Geometry & MOs

Info

ID:	136083
PubChem CID:	51975323
Reduced:	NO3C19H31 (1)
Stoich.:	AB3C19D31 (1)
Weight, g/mol:	310.238219
ΔH_f, kcal/mol:	-138.88
Dipole, Da:	2.96
IP(EA), eV:	-8.71(0.25)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

tert-butyl-[(2R)-2-hydroxy-3-[2-(4-propan-2-ylphenoxy)ethoxy]propyl]azanium

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)OCCOC[C@H](CN2CCCCC2)O

DOS

IR

Vibrations