Geometry & MOs

Info

ID:	270498
PubChem CID:	103636894
Reduced:	IO2N3C13H18 (1)
Stoich.:	AB2C3D13E18 (1)
Weight, g/mol:	270.03678
ΔH_f, kcal/mol:	24.13
Dipole, Da:	10.37
IP(EA), eV:	-9.12(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-[(5-bromopyridin-3-yl)methyl]pyrrolidin-2-yl]methanol

Drug info:

PubChemData

Smile

CN1CCC(CC1)CNC2=CC(=C(C=C2)[N+](=O)[O-])I

DOS

IR

Vibrations