Geometry & MOs

Info

ID:	77571
PubChem CID:	49655519
Reduced:	SO2N4H16C20 (1)
Stoich.:	AB2C4D16E20 (1)
Weight, g/mol:	329.173942
ΔH_f, kcal/mol:	19.66
Dipole, Da:	4.14
IP(EA), eV:	-8.93(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(3-methoxyphenyl)-6-oxopyridazin-1-yl]-N-(3-methylbutyl)acetamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)NC(=O)C2=CC=CC=C2N3C=NC4=CC=CC=C4C3=O)C

DOS

IR

Vibrations