Geometry & MOs

Info

ID:	228299
PubChem CID:	87563856
Reduced:	BrClOSN3H13C14 (1)
Stoich.:	ABCDE3F13G14 (1)
Weight, g/mol:	101.042266
ΔH_f, kcal/mol:	-11.78
Dipole, Da:	10.99
IP(EA), eV:	-8.46(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Br)C(=O)NC(=S)NC2=CC=C(C=C2)N.Cl

DOS

IR

Vibrations