Geometry & MOs

Info

ID:	278060
PubChem CID:	103833077
Reduced:	SN3O4C10H21 (1)
Stoich.:	AB3C4D10E21 (1)
Weight, g/mol:	224.133634
ΔH_f, kcal/mol:	-176.64
Dipole, Da:	5.16
IP(EA), eV:	-9.6(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3S)-2-amino-N-(3,3-difluoro-2-hydroxypropyl)-3-methylpentanamide

Drug info:

PubChemData

Smile

CCNS(=O)(=O)CCNC(=O)C1CC(CN1)OC

DOS

IR

Vibrations