Geometry & MOs

Info

ID:	131571
PubChem CID:	51230337
Reduced:	N3O7C17H25 (1)
Stoich.:	A3B7C17D25 (1)
Weight, g/mol:	374.175419
ΔH_f, kcal/mol:	-196.7
Dipole, Da:	6.64
IP(EA), eV:	-9.58(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-1-(2-fluorophenyl)-6-methyl-4-oxo-N-[2-oxo-2-(propan-2-ylamino)ethyl]pyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CCN(CC(=O)NC(C)C)C(=O)C1=CC(=C(C(=C1[N+](=O)[O-])OC)OC)OC

DOS

IR

Vibrations