Geometry & MOs

Info

ID:	393020
PubChem CID:	135018987
Reduced:	O3C14H22 (1)
Stoich.:	A3B14C22 (1)
Weight, g/mol:	158.961879
ΔH_f, kcal/mol:	-129.03
Dipole, Da:	1.61
IP(EA), eV:	-9.53(0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

carbanide;iron(4+);methanone;nitroxyl anion

Drug info:

PubChemData

Smile

C/C=C/[C@](C)([C@@]1(C=C(C[C@@H](O1)CC=C)C)O)O

DOS

IR

Vibrations