Geometry & MOs

Info

ID:	366286
PubChem CID:	127319743
Reduced:	ON2C8H12 (2)
Stoich.:	AB2C8D12 (2)
Weight, g/mol:	316.153541
ΔH_f, kcal/mol:	-76.53
Dipole, Da:	4.67
IP(EA), eV:	-9.45(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-oxoethyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione

Drug info:

PubChemData

Smile

C1CCC(CC1)CC(=O)NCC(=O)N2CCN3C=CN=C3C2

DOS

IR

Vibrations