Geometry & MOs

Info

ID:	351426
PubChem CID:	127280314
Reduced:	O3N4C17H28 (1)
Stoich.:	A3B4C17D28 (1)
Weight, g/mol:	330.180424
ΔH_f, kcal/mol:	-144.53
Dipole, Da:	6.92
IP(EA), eV:	-8.98(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,5-dimethyl-1-(6-oxo-1H-pyridazin-3-yl)-N-(2-pyrrolidin-1-ylethyl)pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CN(CCN1CCCC1)C(=O)CCN2C(=O)C3(CCCC3)NC2=O

DOS

IR

Vibrations