Geometry & MOs

Info

ID:	26890
PubChem CID:	803224
Reduced:	NOC9H9 (2)
Stoich.:	ABC9D9 (2)
Weight, g/mol:	310.10842
ΔH_f, kcal/mol:	9.15
Dipole, Da:	5.99
IP(EA), eV:	-8.65(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-chloro-5-nitrophenyl)-3-cyclohexylpropanamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC2=CC=C(C=C2)OCCN3C=CN=C3

DOS

IR

Vibrations