Geometry & MOs

Info

ID:	284891
PubChem CID:	104080758
Reduced:	INO2C9H12 (1)
Stoich.:	ABC2D9E12 (1)
Weight, g/mol:	355.94695
ΔH_f, kcal/mol:	-52.36
Dipole, Da:	3.59
IP(EA), eV:	-9.54(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-difluoro-N-(2-iodoethyl)-3-nitrobenzamide

Drug info:

PubChemData

Smile

CCC1=CC=C(O1)C(=O)NCCI

DOS

IR

Vibrations