Geometry & MOs

Info

ID:	327145
PubChem CID:	126689100
Reduced:	NO3C7H13 (1)
Stoich.:	AB3C7D13 (1)
Weight, g/mol:	327.147058
ΔH_f, kcal/mol:	-135.46
Dipole, Da:	3.6
IP(EA), eV:	-9.33(1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(hydroxymethyl)-4-methoxy-4-(4-phenylphenyl)pyrrolidine-1-carboxylic acid

Drug info:

PubChemData

Smile

C1COC2(O1)C[C@@H](NC2)CO

DOS

IR

Vibrations