Geometry & MOs

Info

ID:	319631
PubChem CID:	126656870
Reduced:	FN2O2C15H17 (1)
Stoich.:	AB2C2D15E17 (1)
Weight, g/mol:	778.30831
ΔH_f, kcal/mol:	-61.01
Dipole, Da:	2.95
IP(EA), eV:	-9.85(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-[(4-hydroxynaphthalen-1-yl)-diphenylmethyl]naphthalen-1-yl]oxy-4-[2-(4-hydroxynaphthalen-1-yl)propan-2-yl]naphthalen-1-ol

Drug info:

PubChemData

Smile

CCC(C)(C)C(=O)C1=C(C=CC(=C1)F)C2=NOC(=N2)C

DOS

IR

Vibrations