Geometry & MOs

Info

ID:	281154
PubChem CID:	103905892
Reduced:	ClFNOC15H19 (1)
Stoich.:	ABCDE15F19 (1)
Weight, g/mol:	205.18305
ΔH_f, kcal/mol:	-69.3
Dipole, Da:	3.54
IP(EA), eV:	-9.47(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-N-but-2-ynyl-1,7,7-trimethylbicyclo[2.2.1]heptan-2-amine

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1)Cl)F)NC2CCOC2C3CC3

DOS

IR

Vibrations