Geometry & MOs

Info

ID:	228164
PubChem CID:	87563562
Reduced:	BrSN3O3H12C15 (1)
Stoich.:	ABC3D3E12F15 (1)
Weight, g/mol:	384.96512
ΔH_f, kcal/mol:	-56.07
Dipole, Da:	3.82
IP(EA), eV:	-9.57(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-aminophenyl)carbamothioyl]-4-bromobenzamide;hydrochloride

Drug info:

PubChemData

Smile

C1=CC(=CC=C1C(=O)N)N(C(=O)NC(=O)C2=CC=C(C=C2)Br)S

DOS

IR

Vibrations