Geometry & MOs

Info

ID:	81117
PubChem CID:	49854370
Reduced:	FN2O3C24H27 (1)
Stoich.:	AB2C3D24E27 (1)
Weight, g/mol:	394.225643
ΔH_f, kcal/mol:	-139.57
Dipole, Da:	3.56
IP(EA), eV:	-8.92(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-[3-(2-phenylpropan-2-ylamino)propanoyl]-2,3-dihydroindol-3-yl]butanoic acid

Drug info:

PubChemData

Smile

CC(C)(C1=CC=CC=C1)NCCC(=O)N2C=C(C3=C2C=CC(=C3)F)CCCC(=O)O

DOS

IR

Vibrations