Geometry & MOs

Info

ID:	158161
PubChem CID:	56463081
Reduced:	N4O5C21H26 (1)
Stoich.:	A4B5C21D26 (1)
Weight, g/mol:	408.125612
ΔH_f, kcal/mol:	-96.71
Dipole, Da:	5.16
IP(EA), eV:	-9.01(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1,3-benzothiazol-2-yl)-N-[1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-2-methylpropyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(C1=NC(=NO1)C2CC2)NC(=O)/C=C/C3=CC(=C(C=C3)OCC(=O)N)OC

DOS

IR

Vibrations