Geometry & MOs

Info

ID:	269436
PubChem CID:	103617481
Reduced:	ClION2C16H24 (1)
Stoich.:	ABCD2E16F24 (1)
Weight, g/mol:	402.11681
ΔH_f, kcal/mol:	-40.24
Dipole, Da:	4.2
IP(EA), eV:	-8.65(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-(diethylamino)pentan-2-yl]-2-iodo-3-methylbenzamide

Drug info:

PubChemData

Smile

CCN(CC)CCCC(C)NC(=O)C1=C(C=CC(=C1)Cl)I

DOS

IR

Vibrations