Geometry & MOs

Info

ID:	46730
PubChem CID:	10526737
Reduced:	FN6C25H29 (1)
Stoich.:	AB6C25D29 (1)
Weight, g/mol:	432.252526
ΔH_f, kcal/mol:	62.12
Dipole, Da:	7.7
IP(EA), eV:	-8.77(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[(6aR,9S)-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinolin-9-yl]methyl]-1-cyclohexylpiperazine-2,6-dione

Drug info:

PubChemData

Smile

C1CN(CCN1CCC2=CC=CC=C2)CC(CC3=CNC4=C3C=C(C=C4)N5C=NN=C5)F

DOS

IR

Vibrations