Geometry & MOs

Info

ID:	65849
PubChem CID:	46386939
Reduced:	N3O3C23H23 (1)
Stoich.:	A3B3C23D23 (1)
Weight, g/mol:	375.158292
ΔH_f, kcal/mol:	-26.98
Dipole, Da:	4.04
IP(EA), eV:	-9.1(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=CC(=CC=C1)OC2=NN=C(C=C2)C3=CC=C(C=C3)C(=O)NC4CCCC4

DOS

IR

Vibrations