Geometry & MOs

Info

ID:	410368
PubChem CID:	135083163
Reduced:	O2C5H11 (2)
Stoich.:	A2B5C11 (2)
Weight, g/mol:	1020.198821
ΔH_f, kcal/mol:	-140.65
Dipole, Da:	1.85
IP(EA), eV:	-9.46(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

acetic acid;N,N'-dimethyl-N,N'-bis(pyridin-2-ylmethyl)ethane-1,2-diamine;iron;iron(2+);dihexafluorophosphate;hydrate

Drug info:

PubChemData

Smile

CCC(C)COCC(C)COCOO

DOS

IR

Vibrations