Geometry & MOs

Info

ID:	59133
PubChem CID:	24771146
Reduced:	O3N4H14C21 (1)
Stoich.:	A3B4C14D21 (1)
Weight, g/mol:	330.230728
ΔH_f, kcal/mol:	65.28
Dipole, Da:	6.34
IP(EA), eV:	-8.6(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[(5-pyrrolidin-1-yl-5,6,7,8-tetrahydronaphthalen-2-yl)oxy]ethyl]morpholine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)N2C3=C(C4=CC=CC=C4C2=O)N=C5N3C=CC=C5)[N+](=O)[O-]

DOS

IR

Vibrations