Geometry & MOs

Info

ID:	378169
PubChem CID:	134224244
Reduced:	N2O4C9H14 (1)
Stoich.:	A2B4C9D14 (1)
Weight, g/mol:	393.07373
ΔH_f, kcal/mol:	-165.33
Dipole, Da:	4.07
IP(EA), eV:	-8.94(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R,3R,4R,5R)-3-fluoro-4-hydroxy-3-methyl-5-[[(4S)-4-methyl-2,5-dioxo-1,3,2lambda5-oxazaphospholidin-2-yl]oxymethyl]oxolan-2-yl]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CN(C(=O)NC1)[C@@H]2CO[C@@H](O2)CO

DOS

IR

Vibrations