Geometry & MOs

Info

ID:	246990
PubChem CID:	103066089
Reduced:	ClOC14H17 (1)
Stoich.:	ABC14D17 (1)
Weight, g/mol:	255.066221
ΔH_f, kcal/mol:	-33.89
Dipole, Da:	1.69
IP(EA), eV:	-8.59(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(chloromethyl)prop-2-enoxy]-2,5-dimethyl-4-nitrobenzene

Drug info:

PubChemData

Smile

C=C(COC1=CC2=C(CCCC2)C=C1)CCl

DOS

IR

Vibrations