Geometry & MOs

Info

ID:	207919
PubChem CID:	80471072
Reduced:	NOC15H27 (1)
Stoich.:	ABC15D27 (1)
Weight, g/mol:	339.09979
ΔH_f, kcal/mol:	-60.35
Dipole, Da:	2.85
IP(EA), eV:	-8.45(2.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-[(3-bromo-5-fluorophenyl)methyl]-3-bicyclo[3.1.0]hexanyl]methyl]propan-2-amine

Drug info:

PubChemData

Smile

CC(C)NCC1(CC2CC2C1)CC3CCCO3

DOS

IR

Vibrations