Geometry & MOs

Info

ID:	267944
PubChem CID:	103590520
Reduced:	FON2C12H17 (1)
Stoich.:	ABC2D12E17 (1)
Weight, g/mol:	267.174691
ΔH_f, kcal/mol:	-79.26
Dipole, Da:	2.5
IP(EA), eV:	-8.34(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-amino-4-fluoro-5-methylphenyl)-5-[(dimethylamino)methyl]pyrrolidin-3-ol

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)N)NCC2CC(C2)O

DOS

IR

Vibrations