Geometry & MOs

Info

ID:	288434
PubChem CID:	104316605
Reduced:	NO2C16H27 (1)
Stoich.:	AB2C16D27 (1)
Weight, g/mol:	209.141579
ΔH_f, kcal/mol:	-107.98
Dipole, Da:	3.91
IP(EA), eV:	-8.82(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(methylaminomethyl)phenoxy]butan-2-ol

Drug info:

PubChemData

Smile

CCCNCC1=CC(=C(C(=C1)C)OCCC(C)O)C

DOS

IR

Vibrations