Geometry & MOs

Info

ID:	147258
PubChem CID:	53786912
Reduced:	O7H32C35 (1)
Stoich.:	A7B32C35 (1)
Weight, g/mol:	226.135765
ΔH_f, kcal/mol:	-182.49
Dipole, Da:	6.05
IP(EA), eV:	-8.88(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethyl-1-methoxy-2-(4-methylphenyl)benzene

Drug info:

PubChemData

Smile

CC(CCCC1=CC=CC=C1)OC2=C(C=CC(=C2)C3=CC(=O)C4=C(C=C(C=C4O3)OCC(=O)C5=CC=CC=C5)O)OC

DOS

IR

Vibrations