Geometry & MOs

Info

ID:	18484
PubChem CID:	541664
Reduced:	N2O5C16H28 (1)
Stoich.:	A2B5C16D28 (1)
Weight, g/mol:	328.199822
ΔH_f, kcal/mol:	-261.16
Dipole, Da:	4.05
IP(EA), eV:	-9.96(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-methyl-4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoylamino]hept-2-enoic acid

Drug info:

PubChemData

Smile

CC(C)CC(C=CC(=O)O)NC(=O)C(C)NC(=O)OC(C)(C)C

DOS

IR

Vibrations