Geometry & MOs

Info

ID:

319456

PubChem CID:

126656086

Reduced:

NO16C38H47 (1)

Stoich.:

AB16C38D47 (1)

Weight, g/mol:

267.042547

ΔHf, kcal/mol:

-610.66

Dipole, Da:

6.43

IP(EA), eV:

 -8.8(-1.71)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

methyl (2S)-3-[bis(phosphanyl)amino]-2-[(E)-3-methoxy-3-oxoprop-1-enoxy]propanoate

Drug info:

PubChemData

Smile

C[C@@]1(C[C@@H](C2=C(C3=C(C=C2[C@H]1C(=O)OC)C(=O)C4=C(C(=CC(=C4C3=O)O)[C@]5([C@@H]([C@H]([C@@H](CO5)O)N(C)C)O)C)O)O)OC6C(C7(CC(C7OC)O6)OC)OC)O

DOS

IR

Vibrations