Geometry & MOs

Info

ID:	293238
PubChem CID:	117378221
Reduced:	BrNF2C9H10 (1)
Stoich.:	ABC2D9E10 (1)
Weight, g/mol:	248.99647
ΔH_f, kcal/mol:	-75.41
Dipole, Da:	3.84
IP(EA), eV:	-9.8(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromo-2,3-difluorophenyl)-N-methylethanamine

Drug info:

PubChemData

Smile

CC(C)(C1=C(C(=C(C=C1)F)F)Br)N

DOS

IR

Vibrations