Geometry & MOs

Info

ID:	287209
PubChem CID:	104234011
Reduced:	FINOC15H15 (1)
Stoich.:	ABCDE15F15 (1)
Weight, g/mol:	292.169939
ΔH_f, kcal/mol:	-25.31
Dipole, Da:	0.95
IP(EA), eV:	-9.16(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-fluoro-4-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methoxy]phenyl]ethanamine

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1)OCC2=CC=C(C=C2)I)F)N

DOS

IR

Vibrations