Geometry & MOs

Info

ID:	196372
PubChem CID:	78816777
Reduced:	OSN6C12H20 (1)
Stoich.:	ABC6D12E20 (1)
Weight, g/mol:	337.160183
ΔH_f, kcal/mol:	-18.23
Dipole, Da:	3.22
IP(EA), eV:	-8.73(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-[2-(difluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl]methyl]-N-methylcyclohexanamine

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(=O)CSCC2=NC(=NC(=N2)N)N

DOS

IR

Vibrations