Geometry & MOs

Info

ID:	55421
PubChem CID:	17395372
Reduced:	SN2O4C13H14 (1)
Stoich.:	AB2C4D13E14 (1)
Weight, g/mol:	327.121906
ΔH_f, kcal/mol:	-89.5
Dipole, Da:	2.41
IP(EA), eV:	-9.58(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxobutan-2-yl] 1H-indole-3-carboxylate

Drug info:

PubChemData

Smile

CCC(C(=O)NC1=NOC(=C1)C)OC(=O)C2=CC=CS2

DOS

IR

Vibrations