Geometry & MOs

Info

ID:	272680
PubChem CID:	103751202
Reduced:	SN2O2C11H16 (1)
Stoich.:	AB2C2D11E16 (1)
Weight, g/mol:	238.131742
ΔH_f, kcal/mol:	-77.05
Dipole, Da:	3.92
IP(EA), eV:	-9.63(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(hydroxymethyl)cyclopentyl]-3,5-dimethyl-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC=N1)C(=O)NC2CCCC2CO

DOS

IR

Vibrations