Geometry & MOs

Info

ID:	394540
PubChem CID:	135023156
Reduced:	ON3C13H22 (2)
Stoich.:	AB3C13D22 (2)
Weight, g/mol:	450.292266
ΔH_f, kcal/mol:	-36.85
Dipole, Da:	4.49
IP(EA), eV:	-8.44(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(phenylmethoxymethyl)-1-[2,4,6-tri(propan-2-yl)phenyl]naphthalene

Drug info:

PubChemData

Smile

CCCOCCOCCCC1=CC(=C(C=C1)CN=C2N(CCN2C)C)CN=C3N(CCN3C)C

DOS

IR

Vibrations