Geometry & MOs

Info

ID:	363291
PubChem CID:	127310549
Reduced:	ON2C9H15 (2)
Stoich.:	AB2C9D15 (2)
Weight, g/mol:	363.263425
ΔH_f, kcal/mol:	-78.89
Dipole, Da:	1.98
IP(EA), eV:	-9.06(0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(3-ethyl-1,2,4-oxadiazol-5-yl)ethyl]-N-[(2-methylcyclohexyl)methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCCCC1CNC(=O)N2CCOC(C2)CN3C=C(C=N3)C

DOS

IR

Vibrations