Geometry & MOs

Info

ID:	127197
PubChem CID:	50994209
Reduced:	FN2O2C29H37 (1)
Stoich.:	AB2C2D29E37 (1)
Weight, g/mol:	427.167811
ΔH_f, kcal/mol:	-107.83
Dipole, Da:	6.92
IP(EA), eV:	-8.79(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-4-methyl-1-[methyl(methylamino)amino]-1-oxopentan-2-yl]-4-(5-thiophen-2-yl-1,2,4-oxadiazol-3-yl)benzamide

Drug info:

PubChemData

Smile

CCCCCCN(CCCCCC)C(=O)C(=O)C1=C(N(C2=CC=CC=C21)C)C3=CC=C(C=C3)F

DOS

IR

Vibrations