Geometry & MOs

Info

ID:	381418
PubChem CID:	134972143
Reduced:	O3C14H20 (1)
Stoich.:	A3B14C20 (1)
Weight, g/mol:	455.165227
ΔH_f, kcal/mol:	-111.23
Dipole, Da:	2.64
IP(EA), eV:	-9.74(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-1-[(2R,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-[1-[(2R,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-4-yl]-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

C[C@](CC=C)([C@@H](CO)O)OCC1=CC=CC=C1

DOS

IR

Vibrations