Geometry & MOs

Info

ID:	442647
PubChem CID:	135253632
Reduced:	OPC26H26 (1)
Stoich.:	ABC26D26 (1)
Weight, g/mol:	385.172127
ΔH_f, kcal/mol:	51.9
Dipole, Da:	7.42
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.946596
Charge, e:	1

Chem-info

IUPAC name:

(4-ethyl-5-methylfuran-2-yl)methyl-triphenylphosphanium

Drug info:

PubChemData

Smile

CCC1=COC(=C1C)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations