Geometry & MOs

Info

ID:	294698
PubChem CID:	117483873
Reduced:	BrFNC14H19 (1)
Stoich.:	ABCD14E19 (1)
Weight, g/mol:	299.06849
ΔH_f, kcal/mol:	-38.48
Dipole, Da:	1.76
IP(EA), eV:	-9.43(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(3-bromo-4-fluoro-5-propan-2-ylphenyl)cyclobutyl]methanamine

Drug info:

PubChemData

Smile

CC(C)C1=CC(=C(C(=C1)Br)F)C2(CCC2)CN

DOS

IR

Vibrations