Geometry & MOs

Info

ID:	412401
PubChem CID:	135085292
Reduced:	BrNSO3C10H12 (1)
Stoich.:	ABCD3E10F12 (1)
Weight, g/mol:	884.160908
ΔH_f, kcal/mol:	-95.85
Dipole, Da:	4.81
IP(EA), eV:	-10.05(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

iron;oxoiron;1,10-phenanthroline;dihydrate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NC[C@H](C=O)Br

DOS

IR

Vibrations