Geometry & MOs

Info

ID:	319862
PubChem CID:	126657422
Reduced:	NC15H23 (1)
Stoich.:	AB15C23 (1)
Weight, g/mol:	324.245316
ΔH_f, kcal/mol:	3.4
Dipole, Da:	2.37
IP(EA), eV:	-8.11(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,2-dimethyl-4-phenoxybutyl)-3-(2,2-dimethylpropyl)benzene

Drug info:

PubChemData

Smile

CCC(=C)CCCCC1=CC=C(C=C1)NC

DOS

IR

Vibrations