Geometry & MOs

Info

ID:	290292
PubChem CID:	104426448
Reduced:	ON3C17H23 (1)
Stoich.:	AB3C17D23 (1)
Weight, g/mol:	319.073512
ΔH_f, kcal/mol:	-30.01
Dipole, Da:	3.74
IP(EA), eV:	-8.68(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-chloro-5-fluoro-2-nitroanilino)-N-(2-methoxyethyl)propanamide

Drug info:

PubChemData

Smile

CC1=CC2=CC=CC=C2N=C1NCCC(=O)NCC(C)C

DOS

IR

Vibrations