Geometry & MOs

Info

ID:	408094
PubChem CID:	135080849
Reduced:	O2C11H14 (1)
Stoich.:	A2B11C14 (1)
Weight, g/mol:	194.141913
ΔH_f, kcal/mol:	-60.98
Dipole, Da:	1.31
IP(EA), eV:	-8.91(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3R)-2-(4-methoxyphenyl)butane-1,3-diamine

Drug info:

PubChemData

Smile

C/C=C(/CO)\C1=CC(=CC=C1)OC

DOS

IR

Vibrations