Geometry & MOs

Info

ID:	280955
PubChem CID:	103852155
Reduced:	BrFNOC13H13 (1)
Stoich.:	ABCDE13F13 (1)
Weight, g/mol:	312.9869
ΔH_f, kcal/mol:	-57.87
Dipole, Da:	4.59
IP(EA), eV:	-9.61(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-bromo-5-chlorophenyl)-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)methanone

Drug info:

PubChemData

Smile

CC1=CCN(CC1)C(=O)C2=CC(=C(C=C2)F)Br

DOS

IR

Vibrations