Geometry & MOs

Info

ID:	137425
PubChem CID:	52207087
Reduced:	FN2O2C23H27 (1)
Stoich.:	AB2C2D23E27 (1)
Weight, g/mol:	340.158706
ΔH_f, kcal/mol:	-122.04
Dipole, Da:	4.94
IP(EA), eV:	-9.44(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1S)-1-(2-fluorophenyl)ethyl]-1-propanoyl-2,3-dihydroindole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)C(=O)N2CCC[C@H](C2)C(=O)N[C@H](C)C3=CC=CC=C3F)C

DOS

IR

Vibrations