Geometry & MOs

Info

ID:	179079
PubChem CID:	76430708
Reduced:	NOC7H9 (3)
Stoich.:	ABC7D9 (3)
Weight, g/mol:	429.168856
ΔH_f, kcal/mol:	-117.63
Dipole, Da:	5.2
IP(EA), eV:	-9.56(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

naphthalen-1-yl 7-benzyl-6,9-dioxo-1,3,4,7,8,9a-hexahydropyrazino[1,2-a]pyrazine-2-carboxylate

Drug info:

PubChemData

Smile

C1CCC(CC1)CC2C(=O)N3CCN(CC3C(=O)N2)C(=O)C4=CC=CC=C4

DOS

IR

Vibrations