Geometry & MOs

Info

ID:	12121
PubChem CID:	130686
Reduced:	NO2H25C26 (1)
Stoich.:	AB2C25D26 (1)
Weight, g/mol:	383.188529
ΔH_f, kcal/mol:	18.7
Dipole, Da:	1.28
IP(EA), eV:	-8.4(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[4-[2-(aziridin-1-yl)ethoxy]phenyl]-6-phenyl-7,8-dihydronaphthalen-2-ol

Drug info:

PubChemData

Smile

C1CC(=C(C2=C1C=C(C=C2)O)C3=CC=C(C=C3)OCCN4CC4)C5=CC=CC=C5

DOS

IR

Vibrations