Geometry & MOs

Info

ID:	441170
PubChem CID:	135233403
Reduced:	O3N6C23H34 (1)
Stoich.:	A3B6C23D34 (1)
Weight, g/mol:	351.1044
ΔH_f, kcal/mol:	-25.21
Dipole, Da:	3.49
IP(EA), eV:	-8.48(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[3-(2,2-difluoroethyl)-5-pyridin-4-ylimidazol-4-yl]imidazo[1,2-b]pyridazine-3-carbonitrile

Drug info:

PubChemData

Smile

CC1(CCC(CC1NC(=O)C2=NOC=C2)C3=NC(=C(C=C3)NCC(C)(C)C)N(C)N=O)C

DOS

IR

Vibrations