Geometry & MOs

Info

ID:	193683
PubChem CID:	78423418
Reduced:	FNO2C9H10 (1)
Stoich.:	ABC2D9E10 (1)
Weight, g/mol:	266.096323
ΔH_f, kcal/mol:	-106.9
Dipole, Da:	9.72
IP(EA), eV:	-9.82(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

5-methyl-2-(morpholin-4-ium-4-ylmethyl)-4aH-thieno[2,3-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CC(C(=O)[O-])[NH3+])F

DOS

IR

Vibrations