Geometry & MOs

Info

ID:	444349
PubChem CID:	135262176
Reduced:	NO2F3C18H24 (1)
Stoich.:	AB2C3D18E24 (1)
Weight, g/mol:	341.160263
ΔH_f, kcal/mol:	-223.14
Dipole, Da:	2.23
IP(EA), eV:	-9.22(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-amino-2-(3,3-dimethylspiro[1,2-dihydronaphthalene-4,1'-cyclopropane]-1-yl)ethyl] 2,2,2-trifluoroacetate

Drug info:

PubChemData

Smile

CC1(CC(C2=CC=CC=C2C13CC3)CCN)C.C(=O)(C(F)(F)F)O

DOS

IR

Vibrations