Geometry & MOs

Info

ID:	272472
PubChem CID:	103743666
Reduced:	BrFNOC14H19 (1)
Stoich.:	ABCDE14F19 (1)
Weight, g/mol:	303.144613
ΔH_f, kcal/mol:	-81.21
Dipole, Da:	1.7
IP(EA), eV:	-9.32(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-methyloxan-4-yl)methyl]-1-[2-(trifluoromethoxy)phenyl]methanamine

Drug info:

PubChemData

Smile

CC1(CCOCC1)CNCC2=C(C=C(C=C2)Br)F

DOS

IR

Vibrations