Geometry & MOs

Info

ID:	11986
PubChem CID:	125548
Reduced:	O4C17H18 (1)
Stoich.:	A4B17C18 (1)
Weight, g/mol:	286.120509
ΔH_f, kcal/mol:	-106.64
Dipole, Da:	6.45
IP(EA), eV:	-8.76(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(2,3,4-trimethoxyphenyl)phenyl]ethanone

Drug info:

PubChemData

Smile

CC(=O)C1=CC=C(C=C1)C2=C(C(=C(C=C2)OC)OC)OC

DOS

IR

Vibrations