Geometry & MOs

Info

ID:	403305
PubChem CID:	135059625
Reduced:	O7H24C28 (1)
Stoich.:	A7B24C28 (1)
Weight, g/mol:	407.136887
ΔH_f, kcal/mol:	-202.46
Dipole, Da:	1.99
IP(EA), eV:	-8.84(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(methoxymethoxy)-5-(4-nitrophenyl)phenyl]-1-(4-methoxyphenyl)ethanone

Drug info:

PubChemData

Smile

C1=CC(=CC=C1/C=C/C2=CC(=CC(=C2)O)O)OC(C3=CC(=CC(=C3)O)O)C(C4=CC=C(C=C4)O)O

DOS

IR

Vibrations