Geometry & MOs

Info

ID:	294674
PubChem CID:	117480506
Reduced:	BrNOC14H20 (1)
Stoich.:	ABCD14E20 (1)
Weight, g/mol:	297.07283
ΔH_f, kcal/mol:	-27.77
Dipole, Da:	3.51
IP(EA), eV:	-9.06(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-6-(2-methylpyrrolidin-2-yl)-4-propan-2-ylphenol

Drug info:

PubChemData

Smile

C1CC(C1)COC2=CC(=CC(=C2)CCCN)Br

DOS

IR

Vibrations