Geometry & MOs

Info

ID:	144561
PubChem CID:	53386077
Reduced:	NP2O7C20H35 (1)
Stoich.:	AB2C7D20E35 (1)
Weight, g/mol:	479.183791
ΔH_f, kcal/mol:	-435.37
Dipole, Da:	2.12
IP(EA), eV:	-9.11(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,4R)-3-amino-5,5-bis(diethoxyphosphoryl)-4-(4-methoxyphenyl)pentan-2-one

Drug info:

PubChemData

Smile

CCOP(=O)(C([C@H](C1=CC=CC(=C1)C)[C@@H](C(=O)C)N)P(=O)(OCC)OCC)OCC

DOS

IR

Vibrations