Geometry & MOs

Info

ID:	356620
PubChem CID:	127291846
Reduced:	SO2N5C20H25 (1)
Stoich.:	AB2C5D20E25 (1)
Weight, g/mol:	289.19026
ΔH_f, kcal/mol:	1.69
Dipole, Da:	7.49
IP(EA), eV:	-8.6(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[2-(4-methylpyrazol-1-yl)ethyl]cyclohexan-1-amine

Drug info:

PubChemData

Smile

CC1=CC2=C(C(=CC=C2)S(=O)(=O)N3CCN(CC3)CCN4C=C(C=N4)C)N=C1

DOS

IR

Vibrations