Geometry & MOs

Info

ID:	265748
PubChem CID:	103544019
Reduced:	NF2O2C11H13 (1)
Stoich.:	AB2C2D11E13 (1)
Weight, g/mol:	303.02702
ΔH_f, kcal/mol:	-160.0
Dipole, Da:	0.97
IP(EA), eV:	-9.61(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-bromo-3-fluorophenyl)-3-(1,3-dioxolan-2-yl)propan-2-amine

Drug info:

PubChemData

Smile

C1COC(O1)CC(C2=C(C=CC=C2F)F)N

DOS

IR

Vibrations