Geometry & MOs

Info

ID:	186732
PubChem CID:	77475768
Reduced:	O2N3F4C16H17 (1)
Stoich.:	A2B3C4D16E17 (1)
Weight, g/mol:	173.120449
ΔH_f, kcal/mol:	-241.2
Dipole, Da:	3.81
IP(EA), eV:	-9.58(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-phenylbicyclo[3.1.0]hexan-2-amine

Drug info:

PubChemData

Smile

CC(C(CO)NCC1=C(C=CC(=N1)C2=CN=C(C=C2)C(F)(F)F)F)O

DOS

IR

Vibrations