Geometry & MOs

Info

ID:	278752
PubChem CID:	103837667
Reduced:	O2N4C11H16 (1)
Stoich.:	A2B4C11D16 (1)
Weight, g/mol:	253.09819
ΔH_f, kcal/mol:	56.92
Dipole, Da:	9.51
IP(EA), eV:	-9.28(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-5-[(1-cyclopropylcyclopropyl)methylamino]-2-methylpyridazin-3-one

Drug info:

PubChemData

Smile

CN1C=NC(=C1NCC2(CC2)C3CC3)[N+](=O)[O-]

DOS

IR

Vibrations