Geometry & MOs

Info

ID:	232589
PubChem CID:	87576472
Reduced:	O3C14H16 (1)
Stoich.:	A3B14C16 (1)
Weight, g/mol:	756.495276
ΔH_f, kcal/mol:	-96.05
Dipole, Da:	2.79
IP(EA), eV:	-9.62(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis(2-adamantyl)-[[1-[bis(2-adamantyl)phosphanylmethyl]naphthalen-2-yl]methyl]phosphane

Drug info:

PubChemData

Smile

CC(=C)C(=O)OC(C)(/C=C/C1=CC=CC=C1)O

DOS

IR

Vibrations