Geometry & MOs

Info

ID:	228060
PubChem CID:	87563302
Reduced:	PO3C20H41 (1)
Stoich.:	AB3C20D41 (1)
Weight, g/mol:	182.049843
ΔH_f, kcal/mol:	-248.39
Dipole, Da:	2.5
IP(EA), eV:	-9.59(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

prop-2-enoyl chloride;toluene

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCC/C=C/OP(O)O

DOS

IR

Vibrations