Geometry & MOs

Info

ID:	337557
PubChem CID:	127258180
Reduced:	NO4H5C6 (1)
Stoich.:	AB4C5D6 (1)
Weight, g/mol:	245.081184
ΔH_f, kcal/mol:	-97.84
Dipole, Da:	0.5
IP(EA), eV:	-10.83(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-4-one

Drug info:

PubChemData

Smile

COC(=O)C1=CN=C(O1)C=O

DOS

IR

Vibrations