Geometry & MOs

Info

ID:	406063
PubChem CID:	135076441
Reduced:	FBr2O3Si4C23H43 (1)
Stoich.:	AB2C3D4E23F43 (1)
Weight, g/mol:	469.061742
ΔH_f, kcal/mol:	-294.45
Dipole, Da:	2.39
IP(EA), eV:	-6.94(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

carbon monoxide;[1-methoxy-3-[2-[methyl-[(4-methylphenyl)methyl]amino]phenyl]prop-2-ynylidene]chromium

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CC=C1)[C@@H](CC(C(F)(Br)Br)OC(=O)C)O[Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C

DOS

IR

Vibrations