Geometry & MOs

Info

ID:	319306
PubChem CID:	126655571
Reduced:	ON2C6H9 (2)
Stoich.:	AB2C6D9 (2)
Weight, g/mol:	287.126991
ΔH_f, kcal/mol:	-47.28
Dipole, Da:	3.9
IP(EA), eV:	-8.82(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-benzylpyrazol-3-yl)-3-hydroxypyrrolidine-3-carboxylic acid

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)C2(CCN(C2)C3=CC=NN3)O

DOS

IR

Vibrations