Geometry & MOs

Info

ID:	270005
PubChem CID:	103621897
Reduced:	BrClNO2H13C15 (1)
Stoich.:	ABCD2E13F15 (1)
Weight, g/mol:	383.01824
ΔH_f, kcal/mol:	-49.71
Dipole, Da:	5.4
IP(EA), eV:	-8.68(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-(3-fluorophenyl)-2-iodo-3-methylbenzamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1)NC(=O)C2=C(C=CC(=C2)Cl)Br

DOS

IR

Vibrations