Geometry & MOs

Info

ID:	339862
PubChem CID:	127261871
Reduced:	NO5C11H11 (1)
Stoich.:	AB5C11D11 (1)
Weight, g/mol:	261.103479
ΔH_f, kcal/mol:	-170.68
Dipole, Da:	3.85
IP(EA), eV:	-9.23(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(E)-prop-1-enyl]sulfanylpropanoic acid

Drug info:

PubChemData

Smile

C1=C/C(=C/N[C@@H](CC(=O)O)C(=O)O)/C(=O)C=C1

DOS

IR

Vibrations