Geometry & MOs

Info

ID:	234028
PubChem CID:	92297564
Reduced:	NOH11C12 (2)
Stoich.:	ABC11D12 (2)
Weight, g/mol:	300.989561
ΔH_f, kcal/mol:	19.37
Dipole, Da:	5.63
IP(EA), eV:	-9.39(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-5-chloro-4-[chloro(difluoro)methyl]-5,5-difluoro-4-hydroxy-2-methylpentanoic acid

Drug info:

PubChemData

Smile

C[C@@](C#N)(C1=CC=CC=C1)N(CCC2=CC=CC=C2)C(=O)OC3=CC=CC=C3

DOS

IR

Vibrations