Geometry & MOs

Info

ID:	443521
PubChem CID:	135259248
Reduced:	O2N9C36H39 (1)
Stoich.:	A2B9C36D39 (1)
Weight, g/mol:	282.00039
ΔH_f, kcal/mol:	80.1
Dipole, Da:	8.63
IP(EA), eV:	-8.52(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-8-methylspiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclobutane]-1,5-dione

Drug info:

PubChemData

Smile

CCN(C1=CC2=C(C=C1)NN=C2C3=CN=C(C=C3)C)C(=O)[C@@H]4CCN(C4)CC(=O)N5CCC(=CC5)C6=CC=C(C=C6)C7=NN(C=N7)C

DOS

IR

Vibrations