Geometry & MOs

Info

ID:	61697
PubChem CID:	26711895
Reduced:	Cl2N2S2O5C18H18 (1)
Stoich.:	A2B2C2D5E18F18 (1)
Weight, g/mol:	396.064363
ΔH_f, kcal/mol:	-175.54
Dipole, Da:	5.57
IP(EA), eV:	-9.9(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(2,4-dichlorophenyl)methylamino]-2-oxoethyl]-3,5-dimethoxybenzamide

Drug info:

PubChemData

Smile

C1CS(=O)(=O)C[C@@H]1NS(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=C(C=C(C=C3)Cl)Cl

DOS

IR

Vibrations