Geometry & MOs

Info

ID:	294505
PubChem CID:	117465117
Reduced:	BrFNOC12H15 (1)
Stoich.:	ABCDE12F15 (1)
Weight, g/mol:	287.0321
ΔH_f, kcal/mol:	-73.12
Dipole, Da:	2.7
IP(EA), eV:	-8.91(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-bromo-4-fluoro-3-methyl-2-(2-methylpyrrolidin-2-yl)phenol

Drug info:

PubChemData

Smile

CC1(CCCN1)C2=CC(=C(C=C2F)OC)Br

DOS

IR

Vibrations