Geometry & MOs

Info

ID:	232416
PubChem CID:	87576149
Reduced:	NO3C6H7 (2)
Stoich.:	AB3C6D7 (2)
Weight, g/mol:	437.175084
ΔH_f, kcal/mol:	-157.63
Dipole, Da:	3.65
IP(EA), eV:	-9.66(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3E)-5-fluoro-3-[[3-(3-morpholin-4-yl-3-oxopropyl)-4-oxo-1,5,6,7-tetrahydroindol-2-yl]methylidene]-1H-indol-2-one

Drug info:

PubChemData

Smile

CC1=C(C=C(C(=C1C(=O)OC)NC(=O)C)[N+](=O)[O-])OC

DOS

IR

Vibrations