Geometry & MOs

Info

ID:	33700
PubChem CID:	7887540
Reduced:	OS2N3C20H23 (1)
Stoich.:	AB2C3D20E23 (1)
Weight, g/mol:	329.106336
ΔH_f, kcal/mol:	1.02
Dipole, Da:	3.3
IP(EA), eV:	-8.92(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,3-dihydroindol-1-yl)-2-oxoethyl] 2-fluoro-4-methoxybenzoate

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C(C)C)NC(=O)CSC2=NC=NC3=C2C(=C(S3)C)C

DOS

IR

Vibrations