Geometry & MOs

Info

ID:	365848
PubChem CID:	127318788
Reduced:	ON6C20H26 (1)
Stoich.:	AB6C20D26 (1)
Weight, g/mol:	391.16444
ΔH_f, kcal/mol:	34.28
Dipole, Da:	3.88
IP(EA), eV:	-9.24(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-oxo-2-[2-(1H-pyrazol-4-yl)piperidin-1-yl]ethyl]-4H-pyrazino[1,2-a]indole-1,3-dione

Drug info:

PubChemData

Smile

CCC(C)N1C2=NC(=CC(=C2C=N1)C(=O)N3CCCCC3C4=CNN=C4)C

DOS

IR

Vibrations