Geometry & MOs

Info

ID:	269454
PubChem CID:	103617536
Reduced:	ClINO3C12H13 (1)
Stoich.:	ABCD3E12F13 (1)
Weight, g/mol:	360.03347
ΔH_f, kcal/mol:	-100.64
Dipole, Da:	4.87
IP(EA), eV:	-9.48(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(dimethylamino)-1-oxopropan-2-yl]-2-iodo-3-methylbenzamide

Drug info:

PubChemData

Smile

CN(CCC(=O)OC)C(=O)C1=C(C=CC(=C1)Cl)I

DOS

IR

Vibrations