Geometry & MOs

Info

ID:	269462
PubChem CID:	103617556
Reduced:	ION2C16H21 (1)
Stoich.:	ABC2D16E21 (1)
Weight, g/mol:	402.98808
ΔH_f, kcal/mol:	-19.92
Dipole, Da:	3.65
IP(EA), eV:	-8.7(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(difluoromethoxy)phenyl]-2-iodo-3-methylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C(=O)NC2CCN3C2CCCC3)I

DOS

IR

Vibrations