Geometry & MOs

Info

ID:	378327
PubChem CID:	134224405
Reduced:	ClO4N5H18C21 (1)
Stoich.:	AB4C5D18E21 (1)
Weight, g/mol:	243.121906
ΔH_f, kcal/mol:	-65.27
Dipole, Da:	7.94
IP(EA), eV:	-8.88(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3R,4R,5R)-2-(4-amino-2H-pyrimidin-1-yl)-5-(hydroxymethyl)-3-methyloxolane-3,4-diol

Drug info:

PubChemData

Smile

CN(C)C(=O)C(=O)C1=CC=CC=C1NC2=NC(=NC=C2Cl)NC3=CC=C(C=C3)C(=O)O

DOS

IR

Vibrations