Geometry & MOs

Info

ID:	297226
PubChem CID:	117613576
Reduced:	SN4O7C13H24 (1)
Stoich.:	AB4C7D13E24 (1)
Weight, g/mol:	219.147058
ΔH_f, kcal/mol:	-235.38
Dipole, Da:	4.04
IP(EA), eV:	-9.24(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3S)-2,3-dihydroxy-N-[(2R)-2-hydroxybutyl]-4-methylpentanamide

Drug info:

PubChemData

Smile

C1CCN[C@@H](C1)CONC(=O)[C@@H]2CCCCN2C(=O)NOS(=O)(=O)O

DOS

IR

Vibrations