Geometry & MOs

Info

ID:	341297
PubChem CID:	127263990
Reduced:	BSN2O3C6H9 (1)
Stoich.:	ABC2D3E6F9 (1)
Weight, g/mol:	300.89248
ΔH_f, kcal/mol:	-171.41
Dipole, Da:	6.61
IP(EA), eV:	-9.48(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,7-dibromonaphthalen-1-amine

Drug info:

PubChemData

Smile

B(C1=CN=C(N(C1=O)C)SC)(O)O

DOS

IR

Vibrations