Geometry & MOs

Info

ID:	179078
PubChem CID:	76430707
Reduced:	O2N5C19H23 (1)
Stoich.:	A2B5C19D23 (1)
Weight, g/mol:	369.205242
ΔH_f, kcal/mol:	-6.84
Dipole, Da:	4.24
IP(EA), eV:	-8.82(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzoyl-7-(cyclohexylmethyl)-1,3,4,7,8,9a-hexahydropyrazino[1,2-a]pyrazine-6,9-dione

Drug info:

PubChemData

Smile

CN1CC(=O)N2CCN(CC2C1=O)CC3=CN(N=C3C4=CC=CC=C4)C

DOS

IR

Vibrations