Geometry & MOs

Info

ID:	79953
PubChem CID:	49831792
Reduced:	N3O3C24H29 (1)
Stoich.:	A3B3C24D29 (1)
Weight, g/mol:	339.158292
ΔH_f, kcal/mol:	-84.43
Dipole, Da:	3.13
IP(EA), eV:	-8.37(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6Z)-3-hydroxy-3-methyl-6-[[2-(2-methylbut-3-en-2-yl)-1H-indol-3-yl]methylidene]piperazine-2,5-dione

Drug info:

PubChemData

Smile

C[C@H]1C(=O)N/C(=C\C2=C(NC3=C(C=CC=C23)C/C=C(\C)/CO)C(C)(C)C=C)/C(=O)N1

DOS

IR

Vibrations