Geometry & MOs

Info

ID:	54903
PubChem CID:	17389514
Reduced:	BNO3C11H12 (1)
Stoich.:	ABC3D11E12 (1)
Weight, g/mol:	217.042505
ΔH_f, kcal/mol:	-149.34
Dipole, Da:	2.34
IP(EA), eV:	-8.65(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-chlorophenyl)pyrrolidine;hydrochloride

Drug info:

PubChemData

Smile

B(C1=C2C=CC(=NC2=C(C=C1)OC)C)(O)O

DOS

IR

Vibrations