Geometry & MOs

Info

ID:	216770
PubChem CID:	85086748
Reduced:	N4O4C13H26 (1)
Stoich.:	A4B4C13D26 (1)
Weight, g/mol:	300.158626
ΔH_f, kcal/mol:	-182.66
Dipole, Da:	5.2
IP(EA), eV:	-9.4(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-cyclohexyl-3-(2-phenylethyl)oxadiazol-3-ium-5-yl]-oxidodiazene

Drug info:

PubChemData

Smile

CN1C(CC(=O)N(C1=O)C)NCCN(CCCO)CCO

DOS

IR

Vibrations