Geometry & MOs

Info

ID:	13837
PubChem CID:	399314
Reduced:	BrSN2O2H13C15 (1)
Stoich.:	ABC2D2E13F15 (1)
Weight, g/mol:	363.98811
ΔH_f, kcal/mol:	-10.58
Dipole, Da:	7.07
IP(EA), eV:	-8.97(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromophenyl)-4-(methylcarbamoyloxy)benzenecarboximidothioic acid

Drug info:

PubChemData

Smile

CNC(=O)OC1=CC=C(C=C1)C(=NC2=CC=C(C=C2)Br)S

DOS

IR

Vibrations