Geometry & MOs

Info

ID:	179869
PubChem CID:	76547837
Reduced:	ClO4N5C21H32 (1)
Stoich.:	AB4C5D21E32 (1)
Weight, g/mol:	279.041069
ΔH_f, kcal/mol:	-200.61
Dipole, Da:	3.41
IP(EA), eV:	-8.83(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(6-chloro-4-oxo-3H-pyridazin-3-yl)oxy]phenyl]acetamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N(C(=O)N2C(=O)NC(C(=O)N)C(C)(C)C)CCN3CCOCC3.Cl

DOS

IR

Vibrations