Geometry & MOs

Info

ID:	313013
PubChem CID:	126610767
Reduced:	BrSO2N3H12C14 (1)
Stoich.:	ABC2D3E12F14 (1)
Weight, g/mol:	274.99458
ΔH_f, kcal/mol:	-1.1
Dipole, Da:	4.45
IP(EA), eV:	-8.82(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-bromobenzenecarboximidoyl)phenol

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations