Geometry & MOs

Info

ID:	207920
PubChem CID:	80471073
Reduced:	BrFNC17H23 (1)
Stoich.:	ABCD17E23 (1)
Weight, g/mol:	321.10921
ΔH_f, kcal/mol:	-30.62
Dipole, Da:	3.55
IP(EA), eV:	-9.04(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-[(3-bromophenyl)methyl]-3-bicyclo[3.1.0]hexanyl]methyl]propan-2-amine

Drug info:

PubChemData

Smile

CC(C)NCC1(CC2CC2C1)CC3=CC(=CC(=C3)Br)F

DOS

IR

Vibrations