Geometry & MOs

Info

ID:	7362
PubChem CID:	72270
Reduced:	SO3N5C10H13 (1)
Stoich.:	AB3C5D10E13 (1)
Weight, g/mol:	283.07391
ΔH_f, kcal/mol:	-36.88
Dipole, Da:	4.95
IP(EA), eV:	-9.57(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R,4S,5S)-4-azido-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-4-sulfanylpyrimidin-2-one

Drug info:

PubChemData

Smile

CC1=CN(C(=O)N=C1S)[C@H]2C[C@@H]([C@H](O2)CO)N=[N+]=[N-]

DOS

IR

Vibrations