Geometry & MOs

Info

ID:	398520
PubChem CID:	135033665
Reduced:	NCl2O2H7C8 (1)
Stoich.:	AB2C2D7E8 (1)
Weight, g/mol:	426.16198
ΔH_f, kcal/mol:	-52.01
Dipole, Da:	0.14
IP(EA), eV:	-10.23(-1.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[hydroxy(dinaphthalen-1-yl)methyl]naphthalen-2-ol

Drug info:

PubChemData

Smile

C=CCCN1C(=O)C(=C(C1=O)Cl)Cl

DOS

IR

Vibrations