Geometry & MOs

Info

ID:	120939
PubChem CID:	50751164
Reduced:	ON4C14H18 (1)
Stoich.:	AB4C14D18 (1)
Weight, g/mol:	437.177313
ΔH_f, kcal/mol:	3.54
Dipole, Da:	1.07
IP(EA), eV:	-8.82(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-5-(3-methyl-4-oxo-5,6,7,8-tetrahydrophthalazin-1-yl)-N-(2-methylphenyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C2=NN(C(=N2)N)C(=O)C(C)C)C

DOS

IR

Vibrations