Geometry & MOs

Info

ID:	449208
PubChem CID:	135296858
Reduced:	FN3O3C14H20 (1)
Stoich.:	AB3C3D14E20 (1)
Weight, g/mol:	440.194737
ΔH_f, kcal/mol:	-180.44
Dipole, Da:	2.37
IP(EA), eV:	-9.99(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

10-methoxy-6-(2-methylbutan-2-yl)-2-oxo-9-[(3-oxocyclobutyl)methoxy]-7H-pyrido[2,1-a]phthalazine-3-carboxylic acid

Drug info:

PubChemData

Smile

CCC(C1=C(C=CC(=N1)C(=O)N)F)NC(=O)OC(C)(C)C

DOS

IR

Vibrations