Geometry & MOs

Info

ID:	126670
PubChem CID:	50973033
Reduced:	ON3C19H25 (1)
Stoich.:	AB3C19D25 (1)
Weight, g/mol:	365.140927
ΔH_f, kcal/mol:	4.07
Dipole, Da:	8.23
IP(EA), eV:	-8.83(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(C)C1=C2C(CC(=O)N=C2N(N1)C)CCC3=CC=CC=C3

DOS

IR

Vibrations