Geometry & MOs

Info

ID:	351636
PubChem CID:	127280528
Reduced:	SO2N7C16H21 (1)
Stoich.:	AB2C7D16E21 (1)
Weight, g/mol:	333.18009
ΔH_f, kcal/mol:	31.09
Dipole, Da:	9.95
IP(EA), eV:	-9.52(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-6-[4-(2-pyrrolidin-1-ylacetyl)piperazine-1-carbonyl]pyridazin-3-one

Drug info:

PubChemData

Smile

C1CCN(C1)CC(=O)N2CCN(CC2)C(=O)C3=C(C=CS3)N4C=NN=N4

DOS

IR

Vibrations