Geometry & MOs

Info

ID:	296516
PubChem CID:	117581356
Reduced:	BrN6C13H13 (1)
Stoich.:	AB6C13D13 (1)
Weight, g/mol:	318.02286
ΔH_f, kcal/mol:	106.18
Dipole, Da:	4.18
IP(EA), eV:	-9.07(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(aminomethyl)-3-bromo-N-pyridin-2-ylimidazo[1,2-b]pyridazin-6-amine

Drug info:

PubChemData

Smile

C1=CC2=NC(=C(N2N=C1NC3=CC=NC=C3)Br)CCN

DOS

IR

Vibrations