Geometry & MOs

Info

ID:	260721
PubChem CID:	103201463
Reduced:	NSO2C11H17 (1)
Stoich.:	ABC2D11E17 (1)
Weight, g/mol:	295.035983
ΔH_f, kcal/mol:	-64.23
Dipole, Da:	3.9
IP(EA), eV:	-8.29(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-6-[(4-methoxy-3-nitrophenoxy)methyl]pyridazine

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)OCCCSC)N

DOS

IR

Vibrations