Geometry & MOs

Info

ID:	68790
PubChem CID:	46509094
Reduced:	N3O3H25C28 (1)
Stoich.:	A3B3C25D28 (1)
Weight, g/mol:	407.131506
ΔH_f, kcal/mol:	0.16
Dipole, Da:	6.47
IP(EA), eV:	-8.59(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-N-[1-[4-(methanesulfonamido)anilino]-3-methyl-1-oxobutan-2-yl]benzamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)C2=CC=C(O2)COC3=CC4=CC=CC=C4C=C3)C5=NC6=CC=CC=C6N5

DOS

IR

Vibrations