Geometry & MOs

Info

ID:	336320
PubChem CID:	127255327
Reduced:	ON8C13H20 (1)
Stoich.:	AB8C13D20 (1)
Weight, g/mol:	585.191815
ΔH_f, kcal/mol:	81.03
Dipole, Da:	7.62
IP(EA), eV:	-9.77(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2R)-7-chloro-1-(2,2-dimethylpropanoyl)-2-(2,3,4-trimethoxyphenyl)spiro[2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3,2'-indene]-1',3'-dione

Drug info:

PubChemData

Smile

CC[C@H](C)[C@@H](C(=O)NC1=NNC(=N1)C2CCC2)N3C=NN=N3

DOS

IR

Vibrations