Geometry & MOs

Info

ID:	122578
PubChem CID:	50812922
Reduced:	N2O2C11H11 (2)
Stoich.:	A2B2C11D11 (2)
Weight, g/mol:	438.145868
ΔH_f, kcal/mol:	-91.54
Dipole, Da:	4.15
IP(EA), eV:	-8.75(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-acetamido-3-(4-chlorophenyl)-6-oxopyridazin-1-yl]-N-(2-propan-2-ylphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NN(C(=O)C(=C2)NC(=O)C)CC(=O)NC3=CC(=CC=C3)OC

DOS

IR

Vibrations