Geometry & MOs

Info

ID:	155173
PubChem CID:	56320916
Reduced:	O2N5H23C24 (1)
Stoich.:	A2B5C23D24 (1)
Weight, g/mol:	439.06444
ΔH_f, kcal/mol:	42.15
Dipole, Da:	3.82
IP(EA), eV:	-8.54(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(2,5-dimethylphenyl)ethyl]-2-iodo-4,5-dimethoxybenzamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC2=NC=C(C=C2)NC(=O)NCCC3=NN(C=C3)C4=CC=CC=C4

DOS

IR

Vibrations