Geometry & MOs

Info

ID:	365646
PubChem CID:	127318367
Reduced:	O2N3C14H21 (1)
Stoich.:	A2B3C14D21 (1)
Weight, g/mol:	180.126263
ΔH_f, kcal/mol:	-50.5
Dipole, Da:	2.93
IP(EA), eV:	-9.38(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(cyclohexylmethyl)-3-methyl-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CC1CCC(CC1)N2CC(CC2=O)C3=NC(=NO3)C

DOS

IR

Vibrations