Geometry & MOs

Info

ID:	138999
PubChem CID:	52456405
Reduced:	NO3C16H33 (1)
Stoich.:	AB3C16D33 (1)
Weight, g/mol:	344.222569
ΔH_f, kcal/mol:	-177.04
Dipole, Da:	3.29
IP(EA), eV:	-8.74(1.73)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

benzyl-[(2R)-2-hydroxy-3-[(2-methoxyphenyl)methoxy]propyl]-propan-2-ylazanium

Drug info:

PubChemData

Smile

CC(C)CN(C[C@@H](COC[C@H]1CCCO1)O)CC(C)C

DOS

IR

Vibrations