Geometry & MOs

Info

ID:	145700
PubChem CID:	53577004
Reduced:	N3O3C19H21 (1)
Stoich.:	A3B3C19D21 (1)
Weight, g/mol:	328.201159
ΔH_f, kcal/mol:	-64.84
Dipole, Da:	2.71
IP(EA), eV:	-9.2(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(3-ethyl-2-oxoimidazolidin-1-yl)piperidin-1-yl]-5,6-dimethylpyridazine-4-carbonitrile

Drug info:

PubChemData

Smile

C1CN(CCN1C(=O)CC2=CC=CC=N2)C(=O)COC3=CC=CC=C3

DOS

IR

Vibrations