Geometry & MOs

Info

ID:	365770
PubChem CID:	127318495
Reduced:	SN2O2C17H20 (1)
Stoich.:	AB2C2D17E20 (1)
Weight, g/mol:	321.147727
ΔH_f, kcal/mol:	-64.7
Dipole, Da:	3.49
IP(EA), eV:	-8.66(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-(1-phenylcyclopentyl)-[1,2]oxazolo[5,4-b]pyridine-5-carboxamide

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C=CC3=C2N=C(S3)NC(=O)C4CCCOC4

DOS

IR

Vibrations