Geometry & MOs

Info

ID:	402578
PubChem CID:	135056469
Reduced:	O3C13H14 (1)
Stoich.:	A3B13C14 (1)
Weight, g/mol:	206.13068
ΔH_f, kcal/mol:	-52.77
Dipole, Da:	3.24
IP(EA), eV:	-9.48(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methoxy-4-[1-[(2-methylpropan-2-yl)oxy]ethenyl]benzene

Drug info:

PubChemData

Smile

C=COCCOC(=C)C1=CC=C(C=C1)C=O

DOS

IR

Vibrations