Geometry & MOs

Info

ID:	15845
PubChem CID:	453461
Reduced:	N3O5C10H15 (1)
Stoich.:	A3B5C10D15 (1)
Weight, g/mol:	257.101171
ΔH_f, kcal/mol:	-215.34
Dipole, Da:	1.22
IP(EA), eV:	-9.8(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R,3R,4S,5R)-4-amino-3-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@@H](O2)CO)N)O

DOS

IR

Vibrations