Geometry & MOs

Info

ID:	341469
PubChem CID:	127264162
Reduced:	Cl2N3C7H9 (1)
Stoich.:	A2B3C7D9 (1)
Weight, g/mol:	147.026248
ΔH_f, kcal/mol:	-1.86
Dipole, Da:	6.63
IP(EA), eV:	-10.46(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-3,3-difluoropropan-1-ol;hydrochloride

Drug info:

PubChemData

Smile

C1=CC(=C(N=C1)C#N)CN.Cl.Cl

DOS

IR

Vibrations