Geometry & MOs

Info

ID:	366335
PubChem CID:	127319800
Reduced:	ClON6H17C18 (1)
Stoich.:	ABC6D17E18 (1)
Weight, g/mol:	344.130697
ΔH_f, kcal/mol:	91.38
Dipole, Da:	3.52
IP(EA), eV:	-9.14(-1.02)
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)-4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)butane-1,4-dione

Drug info:

PubChemData

Smile

C1CC1C2=NC(=NN2C3=CC=CC=C3Cl)C(=O)N4CCN5C=CN=C5C4

DOS

IR

Vibrations