Geometry & MOs

Info

ID:	279487
PubChem CID:	103844094
Reduced:	BrNSO2F3H7C12 (1)
Stoich.:	ABCD2E3F7G12 (1)
Weight, g/mol:	257.152812
ΔH_f, kcal/mol:	-162.45
Dipole, Da:	5.89
IP(EA), eV:	-9.18(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzyl-5-(2-methylpropylamino)pyridazin-3-one

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)F)S(=O)(=O)NC2=CC(=C(C=C2F)Br)F

DOS

IR

Vibrations