Geometry & MOs

Info

ID:	398283
PubChem CID:	135032661
Reduced:	OBr2N2H16C21 (1)
Stoich.:	AB2C2D16E21 (1)
Weight, g/mol:	390.173213
ΔH_f, kcal/mol:	51.42
Dipole, Da:	1.17
IP(EA), eV:	-8.66(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-anilino-1-benzyl-3-phenylindol-2-one

Drug info:

PubChemData

Smile

CN1C2=C(C=C(C=C2Br)Br)[C@](C1=O)(C3=CC=CC=C3)NC4=CC=CC=C4

DOS

IR

Vibrations