Geometry & MOs

Info

ID:	205662
PubChem CID:	80132203
Reduced:	BrNOF2H12C15 (1)
Stoich.:	ABCD2E12F15 (1)
Weight, g/mol:	317.02268
ΔH_f, kcal/mol:	-90.56
Dipole, Da:	3.8
IP(EA), eV:	-9.62(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-bromo-2,6-difluorophenyl)-(3-methylpiperidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)NC(=O)C2=C(C=C(C=C2F)Br)F

DOS

IR

Vibrations