Geometry & MOs

Info

ID:	231434
PubChem CID:	87573703
Reduced:	O2C11H22 (1)
Stoich.:	A2B11C22 (1)
Weight, g/mol:	551.252399
ΔH_f, kcal/mol:	-136.12
Dipole, Da:	4.79
IP(EA), eV:	-10.58(0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[[4-[(3-amino-3-cyclopropylpropanoyl)amino]cyclohexyl]amino]-N-(2-chloropyridin-4-yl)-8-(cyclopropylamino)imidazo[1,2-b]pyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CCCCCC[C@H](C(C)C)C(=O)O

DOS

IR

Vibrations