Geometry & MOs

Info

ID:	233846
PubChem CID:	92098535
Reduced:	O3N6C17H18 (1)
Stoich.:	A3B6C17D18 (1)
Weight, g/mol:	340.128388
ΔH_f, kcal/mol:	-14.43
Dipole, Da:	6.88
IP(EA), eV:	-9.8(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(3-cyanopyrazin-2-yl)oxycyclohexyl]-6-oxo-1H-pyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CN1C(=O)C=CC(=N1)C(=O)NC2CCC(CC2)OC3=NC=CN=C3C#N

DOS

IR

Vibrations