Geometry & MOs

Info

ID:	228298
PubChem CID:	87563855
Reduced:	BrSN3O3H12C15 (1)
Stoich.:	ABC3D3E12F15 (1)
Weight, g/mol:	384.96512
ΔH_f, kcal/mol:	-54.43
Dipole, Da:	4.07
IP(EA), eV:	-9.1(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-aminophenyl)carbamothioyl]-3-bromobenzamide;hydrochloride

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations