Geometry & MOs

Info

ID:	336207
PubChem CID:	127255214
Reduced:	O2N5C16H17 (1)
Stoich.:	A2B5C16D17 (1)
Weight, g/mol:	589.08887
ΔH_f, kcal/mol:	33.45
Dipole, Da:	3.74
IP(EA), eV:	-8.66(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,2R)-2-(4-bromophenyl)-1-(3-methoxybenzoyl)spiro[2,3a-dihydro-1H-pyrrolo[1,2-a]quinoline-3,2'-indene]-1',3'-dione

Drug info:

PubChemData

Smile

CC1=CC=C(N1CC(=O)NCC2=NC(=NO2)C3=CC=NC=C3)C

DOS

IR

Vibrations