Geometry & MOs

Info

ID:	441709
PubChem CID:	135241584
Reduced:	ClNSO3F5H7C10 (1)
Stoich.:	ABCD3E5F7G10 (1)
Weight, g/mol:	341.199094
ΔH_f, kcal/mol:	-321.05
Dipole, Da:	1.83
IP(EA), eV:	-10.27(-1.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2R)-2-(dibenzylamino)-3-hydroxypropanoate

Drug info:

PubChemData

Smile

CC(C(=O)Cl)N(C)S(=O)(=O)C1=C(C(=C(C(=C1F)F)F)F)F

DOS

IR

Vibrations