Geometry & MOs

Info

ID:	149721
PubChem CID:	53789396
Reduced:	O5C23H32 (1)
Stoich.:	A5B23C32 (1)
Weight, g/mol:	230.105528
ΔH_f, kcal/mol:	-225.57
Dipole, Da:	4.86
IP(EA), eV:	-9.26(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1H-indol-6-yl)pyrrolidine-3-carboxylic acid

Drug info:

PubChemData

Smile

C[C@@H]1C[C@H]2[C@@H]3CC(=C4CC(=O)C=C[C@@]4([C@H]3C(C[C@@]2([C@]1(C(=O)CO)O)C)O)C)C

DOS

IR

Vibrations