Geometry & MOs

Info

ID:	156124
PubChem CID:	56369229
Reduced:	SN3O5C23H23 (1)
Stoich.:	AB3C5D23E23 (1)
Weight, g/mol:	443.02297
ΔH_f, kcal/mol:	-150.82
Dipole, Da:	7.33
IP(EA), eV:	-9.0(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-hydroxy-3-methoxyphenyl)methyl]-2-iodo-4,5-dimethoxybenzamide

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)C2=C(C3=CC=CC=C3C=C2)O)C(=O)NCC4=CC(=CC=C4)S(=O)(=O)N

DOS

IR

Vibrations