Geometry & MOs

Info

ID:	179077
PubChem CID:	76430454
Reduced:	O2F3N3C27H32 (1)
Stoich.:	A2B3C3D27E32 (1)
Weight, g/mol:	353.185175
ΔH_f, kcal/mol:	-207.45
Dipole, Da:	7.19
IP(EA), eV:	-8.68(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methyl-2-[(1-methyl-3-phenylpyrazol-4-yl)methyl]-3,4,7,9a-tetrahydro-1H-pyrazino[1,2-a]pyrazine-6,9-dione

Drug info:

PubChemData

Smile

CC(C)CNC(=O)C1CC(CN(C1)CC2=CNC3=CC=CC=C32)COC4=CC=CC(=C4)C(F)(F)F

DOS

IR

Vibrations