Geometry & MOs

Info

ID:	26393
PubChem CID:	646071
Reduced:	SN2O2H8C10 (1)
Stoich.:	AB2C2D8E10 (1)
Weight, g/mol:	205.110279
ΔH_f, kcal/mol:	-40.75
Dipole, Da:	5.06
IP(EA), eV:	-9.08(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-phenyl-2-pyrrolidin-1-ylacetic acid

Drug info:

PubChemData

Smile

CC(=O)NC1=NC(=O)C2=CC=CC=C2S1

DOS

IR

Vibrations