Geometry & MOs

Info

ID:	197228
PubChem CID:	78939138
Reduced:	ON2C13H20 (1)
Stoich.:	AB2C13D20 (1)
Weight, g/mol:	269.04153
ΔH_f, kcal/mol:	-30.78
Dipole, Da:	3.5
IP(EA), eV:	-8.18(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-(3-bromo-4-pyrrolidin-1-ylphenyl)ethanol

Drug info:

PubChemData

Smile

C[C@H](C1=CC=C(C=C1)N2CCN(CC2)C)O

DOS

IR

Vibrations