Geometry & MOs

Info

ID:	366312
PubChem CID:	127319777
Reduced:	O2N3C19H19 (1)
Stoich.:	A2B3C19D19 (1)
Weight, g/mol:	370.200491
ΔH_f, kcal/mol:	-12.76
Dipole, Da:	1.52
IP(EA), eV:	-8.76(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC2=CC3=C(C=C2C1)OC=C3CC(=O)N4CCN5C=CN=C5C4

DOS

IR

Vibrations