Geometry & MOs

Info

ID:	384486
PubChem CID:	134977072
Reduced:	PSF3O3H28C30 (1)
Stoich.:	ABC3D3E28F30 (1)
Weight, g/mol:	327.211587
ΔH_f, kcal/mol:	-204.33
Dipole, Da:	11.42
IP(EA), eV:	-9.23(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]-2-phosphabicyclo[2.2.1]hept-5-en-3-yl]pyridine

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)/C=C\CCP(C2=CC=CC=C2)(C3=CC=CC=C3)(C4=CC=CC=C4)OS(=O)(=O)C(F)(F)F

DOS

IR

Vibrations