Geometry & MOs

Info

ID:	243796
PubChem CID:	99239636
Reduced:	NO2C14H18 (2)
Stoich.:	AB2C14D18 (2)
Weight, g/mol:	393.168856
ΔH_f, kcal/mol:	-131.61
Dipole, Da:	7.02
IP(EA), eV:	-8.94(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (3S)-3-phenyl-3-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanoylamino]propanoate

Drug info:

PubChemData

Smile

CCCCN1[C@H]([C@H](CCC1=O)C(=O)NC2=CC=CC(=C2)COCC3CC3)C4=CC=C(C=C4)OC

DOS

IR

Vibrations