Geometry & MOs

Info

ID:	267885
PubChem CID:	103590155
Reduced:	FON3C13H20 (1)
Stoich.:	ABC3D13E20 (1)
Weight, g/mol:	251.14339
ΔH_f, kcal/mol:	-88.49
Dipole, Da:	3.1
IP(EA), eV:	-8.72(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-amino-4-fluoro-5-methylphenyl)-N-methylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CCNC(=O)CN(CC)C1=C(C=C(C(=C1)C)F)N

DOS

IR

Vibrations