Geometry & MOs

Info

ID:	381811
PubChem CID:	134972644
Reduced:	NC15H16 (2)
Stoich.:	AB15C16 (2)
Weight, g/mol:	350.081659
ΔH_f, kcal/mol:	89.41
Dipole, Da:	0.65
IP(EA), eV:	-9.04(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

carbanide;carbon monoxide;iron(2+);methyl (3R)-3-(cyclopenten-1-yl)hexanoate

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1)N[C@@H](C2=CC=CC=C2)[C@H](C3=CC=CC=C3)NC(C)C4=CC=CC=C4

DOS

IR

Vibrations