Geometry & MOs

Info

ID:	411256
PubChem CID:	135084069
Reduced:	ClMgNH8C9 (1)
Stoich.:	ABCD8E9 (1)
Weight, g/mol:	322.00679
ΔH_f, kcal/mol:	-11.22
Dipole, Da:	4.71
IP(EA), eV:	-8.46(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R,5R)-3,4-dihydroxy-5-(hydroxymethyl)selenolan-2-yl]-5-methylpyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=[C-]C2=CC=CC=C2N1.[Mg+2].[Cl-]

DOS

IR

Vibrations