Geometry & MOs

Info

ID:	365643
PubChem CID:	127318364
Reduced:	O2N3C12H17 (1)
Stoich.:	A2B3C12D17 (1)
Weight, g/mol:	180.126263
ΔH_f, kcal/mol:	-42.11
Dipole, Da:	4.42
IP(EA), eV:	-9.58(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-cycloheptyl-3-methyl-1,2,4-oxadiazole

Drug info:

PubChemData

Smile

CC1=NOC(=N1)C2CC(=O)N(C2)C3CCCC3

DOS

IR

Vibrations