Geometry & MOs

Info

ID:	392442
PubChem CID:	135016317
Reduced:	OC4H6 (6)
Stoich.:	AB4C6 (6)
Weight, g/mol:	208.005609
ΔH_f, kcal/mol:	-228.8
Dipole, Da:	4.0
IP(EA), eV:	-9.48(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-1-chloro-5-dimethoxyphosphorylpent-1-en-3-yne

Drug info:

PubChemData

Smile

C[C@H](C[C@@H](C=C)OCOCCOC)OC(=O)C[C@@H]([C@@H](C)C=C)OCC1=CC=CC=C1

DOS

IR

Vibrations