Geometry & MOs

Info

ID:	288454
PubChem CID:	104316838
Reduced:	NO2C14H23 (1)
Stoich.:	AB2C14D23 (1)
Weight, g/mol:	209.141579
ΔH_f, kcal/mol:	-92.75
Dipole, Da:	1.51
IP(EA), eV:	-8.39(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-[(1R)-1-aminoethyl]phenoxy]butan-2-ol

Drug info:

PubChemData

Smile

CCNCC1=C(C=CC(=C1)C)OCCC(C)O

DOS

IR

Vibrations