Geometry & MOs

Info

ID:	410592
PubChem CID:	135083392
Reduced:	P2O3C32H56 (1)
Stoich.:	A2B3C32D56 (1)
Weight, g/mol:	520.359905
ΔH_f, kcal/mol:	-281.02
Dipole, Da:	4.75
IP(EA), eV:	-9.32(2.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,4S)-2,3-bis(dicyclohexylphosphoryl)bicyclo[2.2.1]heptane

Drug info:

PubChemData

Smile

C1CCC(CC1)P(=O)(CC2[C@H]3CC[C@@H](C2CP(=O)(C4CCCCC4)C5CCCCC5)O3)C6CCCCC6

DOS

IR

Vibrations