Geometry & MOs

Info

ID:	277988
PubChem CID:	103832469
Reduced:	O2N3C15H19 (1)
Stoich.:	A2B3C15D19 (1)
Weight, g/mol:	259.132077
ΔH_f, kcal/mol:	-17.39
Dipole, Da:	4.47
IP(EA), eV:	-9.13(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-(2-aminocyclohexyl)-1,2,4-oxadiazol-3-yl]phenol

Drug info:

PubChemData

Smile

CC1CCC(CC1)(C2=NC(=NO2)C3=CC(=CC=C3)O)N

DOS

IR

Vibrations