Geometry & MOs

Info

ID:	337597
PubChem CID:	127258220
Reduced:	NO4C9H9 (1)
Stoich.:	AB4C9D9 (1)
Weight, g/mol:	336.148535
ΔH_f, kcal/mol:	-111.11
Dipole, Da:	3.81
IP(EA), eV:	-9.48(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S)-3-(5-fluoro-1H-indol-3-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Drug info:

PubChemData

Smile

CC(=O)N(C1=CC=C(C=C1)C(=O)O)O

DOS

IR

Vibrations