Geometry & MOs

Info

ID:	157879
PubChem CID:	56437667
Reduced:	FO2N5C23H32 (1)
Stoich.:	AB2C5D23E32 (1)
Weight, g/mol:	416.151826
ΔH_f, kcal/mol:	-97.99
Dipole, Da:	3.05
IP(EA), eV:	-8.33(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-[3-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)propylcarbamoylamino]-1-benzothiophene-2-carboxylate

Drug info:

PubChemData

Smile

CC(C)N(C)C1=C(C=C(C=C1)NC(=O)NCC2=CC(=CC=C2)C(=O)NCCN(C)C)F

DOS

IR

Vibrations