Geometry & MOs

Info

ID:	56875
PubChem CID:	22394633
Reduced:	ClFNH3O3C7 (1)
Stoich.:	ABCD3E3F7 (1)
Weight, g/mol:	433.02081
ΔH_f, kcal/mol:	-56.78
Dipole, Da:	2.81
IP(EA), eV:	-10.86(-1.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(Z)-1-[1-(2-bromophenyl)sulfonylindol-3-yl]ethylideneamino]guanidine

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1C=O)Cl)[N+](=O)[O-])F

DOS

IR

Vibrations