Geometry & MOs

Info

ID:	262134
PubChem CID:	103272138
Reduced:	F2O2N3H11C13 (1)
Stoich.:	A2B2C3D11E13 (1)
Weight, g/mol:	271.132077
ΔH_f, kcal/mol:	-106.34
Dipole, Da:	8.25
IP(EA), eV:	-8.55(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3,5-dimethylphenyl)-1,5,6,7-tetrahydroimidazo[1,2-a]pyrimidine-2-carboxylic acid

Drug info:

PubChemData

Smile

C1CN=C2NC(=CN2C1C3=C(C=CC=C3F)F)C(=O)O

DOS

IR

Vibrations