Geometry & MOs

Info

ID:	65918
PubChem CID:	46387028
Reduced:	N3O5H21C26 (1)
Stoich.:	A3B5C21D26 (1)
Weight, g/mol:	377.173942
ΔH_f, kcal/mol:	-50.06
Dipole, Da:	3.4
IP(EA), eV:	-8.84(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butan-2-yl-3-[6-(2-methoxyphenoxy)pyridazin-3-yl]benzamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)OC2=NN=C(C=C2)C3=CC(=CC=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

DOS

IR

Vibrations