Geometry & MOs

Info

ID:	65898
PubChem CID:	46387001
Reduced:	N3O3H19C21 (1)
Stoich.:	A3B3C19D21 (1)
Weight, g/mol:	363.158292
ΔH_f, kcal/mol:	8.43
Dipole, Da:	6.24
IP(EA), eV:	-8.93(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[6-(4-methoxyphenoxy)pyridazin-3-yl]-N-propan-2-ylbenzamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)OC2=NN=C(C=C2)C3=CC(=CC=C3)C(=O)NC4CC4

DOS

IR

Vibrations