Geometry & MOs

Info

ID:	202701
PubChem CID:	79710679
Reduced:	BrFNC15H15 (1)
Stoich.:	ABCD15E15 (1)
Weight, g/mol:	312.06374
ΔH_f, kcal/mol:	-11.51
Dipole, Da:	2.45
IP(EA), eV:	-8.76(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-bromo-5-fluorophenyl)methyl]-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)NCC2=CC(=CC(=C2)Br)F)C

DOS

IR

Vibrations