Geometry & MOs

Info

ID:	366353
PubChem CID:	127319818
Reduced:	OSN7C12H15 (1)
Stoich.:	ABC7D12E15 (1)
Weight, g/mol:	365.196408
ΔH_f, kcal/mol:	96.82
Dipole, Da:	1.44
IP(EA), eV:	-9.42(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-[1-(4,6-dimethylpyrimidin-2-yl)-3,5-dimethylpyrazol-4-yl]ethanone

Drug info:

PubChemData

Smile

C1CC1N2C(=NN=N2)SCC(=O)N3CCN4C=CN=C4C3

DOS

IR

Vibrations