Geometry & MOs

Info

ID:	285040
PubChem CID:	104092708
Reduced:	OSC12H14 (1)
Stoich.:	ABC12D14 (1)
Weight, g/mol:	347.91836
ΔH_f, kcal/mol:	29.96
Dipole, Da:	1.64
IP(EA), eV:	-8.7(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,4-dibromo-2-methoxy-5-pent-4-ynoxybenzene

Drug info:

PubChemData

Smile

CSC1=CC=CC=C1OCCCC#C

DOS

IR

Vibrations