Geometry & MOs

Info

ID:	47013
PubChem CID:	10528927
Reduced:	BrSO4N5C18H24 (1)
Stoich.:	ABC4D5E18F24 (1)
Weight, g/mol:	365.149284
ΔH_f, kcal/mol:	-69.01
Dipole, Da:	10.31
IP(EA), eV:	-8.65(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCCCN(CC)C1=NC(=NC(=C1[N+](=O)[O-])NC2=C(C=C(C=C2)S(=O)(=O)C)Br)C

DOS

IR

Vibrations