Geometry & MOs

Info

ID:	10728
PubChem CID:	107461
Reduced:	N3O6C11H15 (1)
Stoich.:	A3B6C11D15 (1)
Weight, g/mol:	285.096085
ΔH_f, kcal/mol:	-242.93
Dipole, Da:	3.76
IP(EA), eV:	-9.94(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-4-yl]acetamide

Drug info:

PubChemData

Smile

CC(=O)NC1=NC(=O)N(C=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O

DOS

IR

Vibrations