Geometry & MOs

Info

ID:	272220
PubChem CID:	103736010
Reduced:	ClINO2C15H19 (1)
Stoich.:	ABCD2E15F19 (1)
Weight, g/mol:	405.94036
ΔH_f, kcal/mol:	-67.13
Dipole, Da:	6.49
IP(EA), eV:	-9.49(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-4-iodo-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CCCOC1CCCN(C1)C(=O)C2=CC(=C(C=C2)I)Cl

DOS

IR

Vibrations