Geometry & MOs

Info

ID:	81214
PubChem CID:	49854471
Reduced:	F2N2O3C23H26 (1)
Stoich.:	A2B2C3D23E26 (1)
Weight, g/mol:	428.209993
ΔH_f, kcal/mol:	-197.43
Dipole, Da:	5.1
IP(EA), eV:	-9.08(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(C1=CC=CC=C1)NCCC(=O)N2CCC3=C(C(=C(C=C32)F)F)CCC(=O)O

DOS

IR

Vibrations