Geometry & MOs

Info

ID:	187406
PubChem CID:	77570786
Reduced:	F3O3N4H13C18 (1)
Stoich.:	A3B3C4D13E18 (1)
Weight, g/mol:	236.116092
ΔH_f, kcal/mol:	-214.18
Dipole, Da:	6.16
IP(EA), eV:	-9.46(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-2-(phenoxymethyl)pyrrolidine-1-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)NC(=O)C23C(=O)NC(=O)N3CC4=CN=C(C=C4)C(F)(F)F

DOS

IR

Vibrations