Geometry & MOs

Info

ID:	261196
PubChem CID:	103222001
Reduced:	OSN3C14H17 (1)
Stoich.:	ABC3D14E17 (1)
Weight, g/mol:	405.03564
ΔH_f, kcal/mol:	33.92
Dipole, Da:	5.83
IP(EA), eV:	-8.83(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-4-iodo-N-(4-propylcyclohexyl)benzamide

Drug info:

PubChemData

Smile

C1CC1CNC2=CC(=O)N(N=C2)CCC3=CSC=C3

DOS

IR

Vibrations