Geometry & MOs

Info

ID:	400251
PubChem CID:	135046972
Reduced:	FePSiO3F6C14H17 (1)
Stoich.:	ABCD3E6F14G17 (1)
Weight, g/mol:	323.061348
ΔH_f, kcal/mol:	-544.67
Dipole, Da:	4.89
IP(EA), eV:	-8.69(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3aR,4R)-4-ethyl-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]indole;carbon monoxide;chromium

Drug info:

PubChemData

Smile

COC(=[Fe+])C#C[Si](C)(C)C.[C-]#[O+].[C-]#[O+].C1=C[CH]C=C1.F[P-](F)(F)(F)(F)F

DOS

IR

Vibrations