Geometry & MOs

Info

ID:	336525
PubChem CID:	127255532
Reduced:	SN2O5C22H42 (1)
Stoich.:	AB2C5D22E42 (1)
Weight, g/mol:	265.098394
ΔH_f, kcal/mol:	-297.98
Dipole, Da:	4.12
IP(EA), eV:	-8.68(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoic acid

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N[C@@H](CSC)C(C(=O)O)O.C1CCC(CC1)NC2CCCCC2

DOS

IR

Vibrations