Geometry & MOs

Info

ID:	65810
PubChem CID:	46386894
Reduced:	NOC8H9 (3)
Stoich.:	ABC8D9 (3)
Weight, g/mol:	375.158292
ΔH_f, kcal/mol:	-24.96
Dipole, Da:	10.93
IP(EA), eV:	-9.25(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[6-(2-methoxyphenoxy)pyridazin-3-yl]phenyl]-pyrrolidin-1-ylmethanone

Drug info:

PubChemData

Smile

CCCN(CCC)C(=O)C1=CC=C(C=C1)C2=NN=C(C=C2)OC3=CC=CC=C3OC

DOS

IR

Vibrations