Geometry & MOs

Info

ID:	215991
PubChem CID:	85085549
Reduced:	NO4C10H11 (1)
Stoich.:	AB4C10D11 (1)
Weight, g/mol:	209.080041
ΔH_f, kcal/mol:	-90.66
Dipole, Da:	7.71
IP(EA), eV:	-9.26(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-1-[5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]pyrimidin-4-one

Drug info:

PubChemData

Smile

COC1=CC=CC=C1CON=CC(=O)O

DOS

IR

Vibrations