Geometry & MOs

Info

ID:	51925
PubChem CID:	12014694
Reduced:	CrO5C19H24 (1)
Stoich.:	AB5C19D24 (1)
Weight, g/mol:	242.13068
ΔH_f, kcal/mol:	-99.78
Dipole, Da:	4.96
IP(EA), eV:	-8.19(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methoxy-3-(methoxymethyl)-2-(2-methylphenyl)benzene

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C2=C(C=CC=C2OC)COC.C=O.C=O.C=O.[Cr]

DOS

IR

Vibrations