Geometry & MOs

Info

ID:	295570
PubChem CID:	117534437
Reduced:	BrN4H11C13 (1)
Stoich.:	AB4C11D13 (1)
Weight, g/mol:	219.100777
ΔH_f, kcal/mol:	95.05
Dipole, Da:	2.14
IP(EA), eV:	-9.21(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-8-propylimidazo[1,2-c]pyrimidine-3-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C2=CN=CN3C2=NC(=C3)CN)Br

DOS

IR

Vibrations