Geometry & MOs

Info

ID:	186692
PubChem CID:	77468016
Reduced:	ON3C10H13 (2)
Stoich.:	AB3C10D13 (2)
Weight, g/mol:	367.180839
ΔH_f, kcal/mol:	-13.1
Dipole, Da:	5.73
IP(EA), eV:	-8.82(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(3-aminophenyl)-4-[(2-fluoro-2-methylcyclopentyl)amino]pyrrolo[1,2-b]pyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CC1(C(CCC1(C)O)NC2=C(C=NN3C2=CC(=C3)C4=CC=NN4C)C(=O)N)C

DOS

IR

Vibrations