Geometry & MOs

Info

ID:	343354
PubChem CID:	127266527
Reduced:	FN3C15H18 (1)
Stoich.:	AB3C15D18 (1)
Weight, g/mol:	307.178358
ΔH_f, kcal/mol:	31.85
Dipole, Da:	2.55
IP(EA), eV:	-8.95(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S,4R)-4-hydroxy-1-[[3-(2-methylpropoxy)phenyl]methyl]pyrrolidine-2-carboxylate

Drug info:

PubChemData

Smile

CN1C=C(C=N1)CN(C)CC=CC2=CC=C(C=C2)F

DOS

IR

Vibrations