Geometry & MOs

Info

ID:	169088
PubChem CID:	75061786
Reduced:	FN4O4H25C27 (1)
Stoich.:	AB4C4D25E27 (1)
Weight, g/mol:	439.141117
ΔH_f, kcal/mol:	-72.13
Dipole, Da:	8.34
IP(EA), eV:	-8.85(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-chloro-6-methoxyquinolin-3-yl)methylideneamino]-5-(4-methoxyphenyl)pyrazolidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC2C(CC1F)C(=O)C(=CO2)C=NNC(=O)COC3=CC=CC=C3C4=CC=NN4C5=CC=CC=C5

DOS

IR

Vibrations