Geometry & MOs

Info

ID:	295711
PubChem CID:	117543321
Reduced:	BrNOC12H16 (1)
Stoich.:	ABCD12E16 (1)
Weight, g/mol:	269.04153
ΔH_f, kcal/mol:	-26.17
Dipole, Da:	1.04
IP(EA), eV:	-8.99(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(4-bromophenyl)-1-methylpyrrolidin-3-yl]methanol

Drug info:

PubChemData

Smile

CN1CCC(C1)(CO)C2=CC(=CC=C2)Br

DOS

IR

Vibrations