Geometry & MOs

Info

ID:	149937
PubChem CID:	53789619
Reduced:	C31H52 (1)
Stoich.:	A31B52 (1)
Weight, g/mol:	337.167794
ΔH_f, kcal/mol:	-86.94
Dipole, Da:	0.14
IP(EA), eV:	-8.82(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-hydroxy-2-(1-naphthalen-1-ylpropan-2-ylamino)ethyl]benzene-1,2-diol

Drug info:

PubChemData

Smile

CCCCCCCC1=CC=C(C=C1)CC2CCC(CC2)C3CCC(CC3)CCCCC

DOS

IR

Vibrations