Geometry & MOs

Info

ID:	73665
PubChem CID:	48419688
Reduced:	N2O3C20H20 (1)
Stoich.:	A2B3C20D20 (1)
Weight, g/mol:	352.169939
ΔH_f, kcal/mol:	-58.85
Dipole, Da:	4.95
IP(EA), eV:	-8.94(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-cyano-3-fluoroanilino)ethyl]-2-(2,3-dihydroindol-1-yl)propanamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CCNC(=O)C2=CC3=CC=CC=C3C(=N2)OC

DOS

IR

Vibrations