Geometry & MOs

Info

ID:	449482
PubChem CID:	135298973
Reduced:	NO2C18H25 (1)
Stoich.:	AB2C18D25 (1)
Weight, g/mol:	346.19328
ΔH_f, kcal/mol:	-67.37
Dipole, Da:	2.59
IP(EA), eV:	-9.54(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-ethoxy-5-methylphenyl)-2-methoxy-5-methyl-4-(2-methylphenyl)benzene

Drug info:

PubChemData

Smile

CCC1=C(C(=O)N(C1=O)CCCCC2CC3CC2C=C3)C

DOS

IR

Vibrations