Geometry & MOs

Info

ID:	208282
PubChem CID:	80512137
Reduced:	ON5C15H17 (1)
Stoich.:	AB5C15D17 (1)
Weight, g/mol:	286.142976
ΔH_f, kcal/mol:	99.9
Dipole, Da:	4.34
IP(EA), eV:	-7.7(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-[3-(5-methyl-2-propan-2-ylphenoxy)-1H-pyridazin-4-ylidene]-nitrosomethanamine

Drug info:

PubChemData

Smile

C1CN(CCC2=CC=CC=C21)C\3=NNC=C/C3=C(/N)\N=O

DOS

IR

Vibrations