Geometry & MOs

Info

ID:	366294
PubChem CID:	127319751
Reduced:	ON5C17H23 (1)
Stoich.:	AB5C17D23 (1)
Weight, g/mol:	359.087453
ΔH_f, kcal/mol:	33.0
Dipole, Da:	10.7
IP(EA), eV:	-8.99(0.13)
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-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanone

Drug info:

PubChemData

Smile

CC(C)(C)N1C(=CC(=N1)C(=O)N2CCN3C=CN=C3C2)C4CC4

DOS

IR

Vibrations