Geometry & MOs

Info

ID:	323981
PubChem CID:	126676712
Reduced:	OF2N8C21H28 (1)
Stoich.:	AB2C8D21E28 (1)
Weight, g/mol:	545.132994
ΔH_f, kcal/mol:	-56.37
Dipole, Da:	5.51
IP(EA), eV:	-8.38(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butan-2-yl (2S)-2-[[[(2R,3R,4S,5R)-4-chloro-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy-phenoxyphosphoryl]amino]propanoate

Drug info:

PubChemData

Smile

C1CNCC1C2=CC(=C(C=C2)OC(F)F)CN=C/C(=C\N)/CC3=CC(=NC(=C3N)NN)N

DOS

IR

Vibrations