Geometry & MOs

Info

ID:	207055
PubChem CID:	80339237
Reduced:	ON3C14H23 (1)
Stoich.:	AB3C14D23 (1)
Weight, g/mol:	298.112899
ΔH_f, kcal/mol:	-30.87
Dipole, Da:	3.35
IP(EA), eV:	-8.52(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-(5-amino-2,4-difluorobenzoyl)-4-methylpyrrolidine-3-carboxylate

Drug info:

PubChemData

Smile

C[C@H](C1=CC(=NC=C1)N(C)C2CCN(CC2)C)O

DOS

IR

Vibrations