Geometry & MOs

Info

ID:	81556
PubChem CID:	49854860
Reduced:	N3O4C12H17 (1)
Stoich.:	A3B4C12D17 (1)
Weight, g/mol:	261.07255
ΔH_f, kcal/mol:	-145.56
Dipole, Da:	7.95
IP(EA), eV:	-9.38(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sodium;2-(6-morpholin-4-yl-4-oxo-1H-pyrimidin-2-yl)acetate

Drug info:

PubChemData

Smile

CCOC(=O)CC1=NC(=O)C=C(N1)N2CCOCC2

DOS

IR

Vibrations