Geometry & MOs

Info

ID:	305535
PubChem CID:	124958721
Reduced:	FSO2N4C14H17 (1)
Stoich.:	ABC2D4E14F17 (1)
Weight, g/mol:	349.153875
ΔH_f, kcal/mol:	-69.12
Dipole, Da:	6.7
IP(EA), eV:	-9.05(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(6R)-6-(2-methoxyphenyl)-3-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl]-pyridazin-3-ylmethanone

Drug info:

PubChemData

Smile

CS(=O)(=O)C1=C(NN=C1)[C@@H]2CCCN(C2)C3=NC=C(C=C3)F

DOS

IR

Vibrations