Geometry & MOs

Info

ID:	322114
PubChem CID:	126668705
Reduced:	NOF3C12H12 (1)
Stoich.:	ABC3D12E12 (1)
Weight, g/mol:	194.04399
ΔH_f, kcal/mol:	-193.99
Dipole, Da:	4.88
IP(EA), eV:	-9.3(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-amino-5-oxoimidazo[1,2-a]pyrimidine-6-carboxylic acid

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(F)(F)F)N2CCCC2=O

DOS

IR

Vibrations