Geometry & MOs

Info

ID:	179098
PubChem CID:	76432876
Reduced:	FN4O4C22H23 (1)
Stoich.:	AB4C4D22E23 (1)
Weight, g/mol:	367.120192
ΔH_f, kcal/mol:	-175.34
Dipole, Da:	4.03
IP(EA), eV:	-9.29(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1C(CN2C1C(=O)NC(C2=O)CC3=CC=C(C=C3)O)NC(=O)NCC4=CC(=CC=C4)F

DOS

IR

Vibrations