Geometry & MOs

Info

ID:	310318
PubChem CID:	126578640
Reduced:	O5C13H22 (1)
Stoich.:	A5B13C22 (1)
Weight, g/mol:	434.124288
ΔH_f, kcal/mol:	-262.25
Dipole, Da:	2.89
IP(EA), eV:	-10.42(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclopentyl (2R)-2-[[(4-nitrophenoxy)-phenoxyphosphoryl]amino]propanoate

Drug info:

PubChemData

Smile

CC[C@@H]1[C@H]([C@H](C(O1)OC(=O)C)OC(=O)C)C(C)C

DOS

IR

Vibrations