Geometry & MOs

Info

ID:	296513
PubChem CID:	117581109
Reduced:	BrNO2C13H20 (1)
Stoich.:	ABC2D13E20 (1)
Weight, g/mol:	267.148396
ΔH_f, kcal/mol:	-81.16
Dipole, Da:	3.28
IP(EA), eV:	-9.15(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(aminomethyl)-N-[(3-methylphenyl)methyl]imidazo[1,2-b]pyridazin-6-amine

Drug info:

PubChemData

Smile

CN(CCC1=CC=CC=C1Br)C(CCO)CO

DOS

IR

Vibrations