Geometry & MOs

Info

ID:	201598
PubChem CID:	79562004
Reduced:	NOC16H31 (1)
Stoich.:	ABC16D31 (1)
Weight, g/mol:	295.150306
ΔH_f, kcal/mol:	-73.42
Dipole, Da:	0.74
IP(EA), eV:	-8.78(2.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-bicyclo[2.2.1]heptanyl)-1-(3-chloro-4-fluorophenyl)-N-ethylethanamine

Drug info:

PubChemData

Smile

CC(C)C(CC1CC2CCC1C2)CNCCOC

DOS

IR

Vibrations