Geometry & MOs

Info

ID:	76972
PubChem CID:	48425645
Reduced:	F2N2O4C15H20 (1)
Stoich.:	A2B2C4D15E20 (1)
Weight, g/mol:	360.190989
ΔH_f, kcal/mol:	-259.0
Dipole, Da:	5.14
IP(EA), eV:	-9.32(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-5-ethyl-1-(6-methoxypyridazin-3-yl)pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C1=CC(=C(C=C1)OC)OC(F)F

DOS

IR

Vibrations