Geometry & MOs

Info

ID:

384133

PubChem CID:

134976400

Reduced:

NPO5C22H31 (1)

Stoich.:

ABC5D22E31 (1)

Weight, g/mol:

294.179512

ΔHf, kcal/mol:

-211.65

Dipole, Da:

6.99

IP(EA), eV:

0.0(0.0)

Spin(Sz, S2):

0.500000, 0.759184

Charge, e:

0

Chem-info

IUPAC name:

(S)-tert-butyl-[tert-butyl-[tert-butyl(methyl)phosphanyl]phosphanyl]-methylphosphane

Drug info:

PubChemData

Smile

CC[NH+](CC)CC.C1=CC=C(C=C1)C[C@H](C(=O)OCC2=CC=CC=C2)O[P+](=O)[O-]

DOS

IR

Vibrations