Geometry & MOs

Info

ID:	33694
PubChem CID:	7887527
Reduced:	OS2N3H21C23 (1)
Stoich.:	AB2C3D21E23 (1)
Weight, g/mol:	371.012741
ΔH_f, kcal/mol:	50.57
Dipole, Da:	2.74
IP(EA), eV:	-8.75(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,5-dichloroanilino)-2-oxoethyl] 2-fluoro-4-methoxybenzoate

Drug info:

PubChemData

Smile

CC1=C(SC2=C1C(=NC=N2)SCC(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4)C

DOS

IR

Vibrations