Geometry & MOs

Info

ID:	173702
PubChem CID:	75671970
Reduced:	O3N4C26H34 (1)
Stoich.:	A3B4C26D34 (1)
Weight, g/mol:	429.047594
ΔH_f, kcal/mol:	-90.36
Dipole, Da:	6.33
IP(EA), eV:	-8.37(0.0)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(2-chlorophenyl)-[4-[3-(2-fluoroanilino)-3-oxoprop-1-enyl]phenyl]sulfonylazanide

Drug info:

PubChemData

Smile

CCN(CC(=O)NCC(C1=CC=C(C=C1)OC)C2=CNC3=CC=CC=C32)CC(=O)NC(C)C

DOS

IR

Vibrations