Geometry & MOs

Info

ID:	257699
PubChem CID:	103148082
Reduced:	NOF3C13H24 (1)
Stoich.:	ABC3D13E24 (1)
Weight, g/mol:	273.134049
ΔH_f, kcal/mol:	-246.47
Dipole, Da:	2.14
IP(EA), eV:	-9.36(0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-4-(2,2,2-trifluoroethoxy)butan-2-amine

Drug info:

PubChemData

Smile

CCC1CCCC(C1)C(CCOCC(F)(F)F)N

DOS

IR

Vibrations