Geometry & MOs

Info

ID:	430904
PubChem CID:	135170974
Reduced:	ON2C12H15 (2)
Stoich.:	AB2C12D15 (2)
Weight, g/mol:	334.204513
ΔH_f, kcal/mol:	3.98
Dipole, Da:	4.45
IP(EA), eV:	-8.62(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(benzylamino)cyclohex-3-en-1-yl]-N-ethylbenzamide

Drug info:

PubChemData

Smile

CCN([C@H]1CCC=C(C1)NCC2=CC(=NO2)C(C)C)C(=O)C3=CC4=CC=CC=C4N3

DOS

IR

Vibrations