Geometry & MOs

Info

ID:	351403
PubChem CID:	127280291
Reduced:	S2N3O3C16H25 (1)
Stoich.:	A2B3C3D16E25 (1)
Weight, g/mol:	278.174276
ΔH_f, kcal/mol:	-98.07
Dipole, Da:	4.88
IP(EA), eV:	-8.75(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,3,4-trimethyl-6-oxo-N-(2-pyrrolidin-1-ylethyl)-1H-pyridazine-5-carboxamide

Drug info:

PubChemData

Smile

CN(CCN1CCCC1)C(=O)C2=C(C=CS2)S(=O)(=O)N3CCCC3

DOS

IR

Vibrations