Geometry & MOs

Info

ID:	282672
PubChem CID:	103935587
Reduced:	BrFON2C12H16 (1)
Stoich.:	ABCD2E12F16 (1)
Weight, g/mol:	253.147807
ΔH_f, kcal/mol:	-79.08
Dipole, Da:	5.14
IP(EA), eV:	-8.09(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-2-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]propane-1,3-diol

Drug info:

PubChemData

Smile

CC(C1=C(C=C(C=C1)F)Br)NCC(=O)N(C)C

DOS

IR

Vibrations