Geometry & MOs

Info

ID:	139065
PubChem CID:	52467512
Reduced:	O2N3C10H13 (1)
Stoich.:	A2B3C10D13 (1)
Weight, g/mol:	207.100777
ΔH_f, kcal/mol:	5.37
Dipole, Da:	1.84
IP(EA), eV:	-9.7(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-N-(4-methyl-1,2,5-oxadiazol-3-yl)cyclohex-3-ene-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NON=C1NC(=O)[C@@H]2CCC=CC2

DOS

IR

Vibrations