Geometry & MOs

Info

ID:	192850
PubChem CID:	78319771
Reduced:	ClFSN4O4H14C21 (1)
Stoich.:	ABCD4E4F14G21 (1)
Weight, g/mol:	416.109625
ΔH_f, kcal/mol:	-79.81
Dipole, Da:	8.43
IP(EA), eV:	-9.39(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[3-(1-benzofuran-2-yl)imidazo[1,2-b]pyridazin-6-yl]oxycyclobutyl]-2,2,2-trifluoroacetamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=C(C(=N2)OC3=C(C=C(C=C3)F)Cl)C(=O)NC4=CC(=CC=C4)S(=O)(=O)N

DOS

IR

Vibrations