Geometry & MOs

Info

ID:	233001
PubChem CID:	87577921
Reduced:	OCl2N4F6C26H28 (1)
Stoich.:	AB2C4D6E26F28 (1)
Weight, g/mol:	331.14514
ΔH_f, kcal/mol:	-345.6
Dipole, Da:	4.5
IP(EA), eV:	-9.17(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-6-[4-[1-[(2R)-2-methylpyrrolidin-1-yl]propoxy]phenyl]pyridazine

Drug info:

PubChemData

Smile

C1CC1CC2(CCN(C2)CC3=CC4=C(C=C3)NN=C4)C(=O)NCC5=CC(=CC(=C5)C(F)(F)F)C(F)(F)F.Cl.Cl

DOS

IR

Vibrations