Geometry & MOs

Info

ID:	375216
PubChem CID:	131480913
Reduced:	FN2O2C10H11 (1)
Stoich.:	AB2C2D10E11 (1)
Weight, g/mol:	220.045962
ΔH_f, kcal/mol:	-100.08
Dipole, Da:	4.28
IP(EA), eV:	-8.63(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-2,2-difluoro-1-(4-fluoro-3-nitrophenyl)ethanamine

Drug info:

PubChemData

Smile

C[C@@]1(C2=CC(=C(C=C2NC1=O)F)OC)N

DOS

IR

Vibrations