Geometry & MOs

Info

ID:	427854
PubChem CID:	135164459
Reduced:	NO7C19H33 (1)
Stoich.:	AB7C19D33 (1)
Weight, g/mol:	446.241687
ΔH_f, kcal/mol:	-369.58
Dipole, Da:	4.42
IP(EA), eV:	-10.02(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 2-[4-(1H-indol-3-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]butan-2-yl]propanedioate

Drug info:

PubChemData

Smile

CCOC(=O)C(C(C)C(CCC(=O)C)NC(=O)OC(C)(C)C)C(=O)OCC

DOS

IR

Vibrations