Geometry & MOs

Info

ID:	190404
PubChem CID:	77998538
Reduced:	SiF3N4O5C24H33 (1)
Stoich.:	AB3C4D5E24F33 (1)
Weight, g/mol:	266.082205
ΔH_f, kcal/mol:	-327.67
Dipole, Da:	4.12
IP(EA), eV:	-8.88(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-cyanophenyl)methyl]pyrrolidine-2-carboxylic acid;hydrochloride

Drug info:

PubChemData

Smile

CC(C)[Si](C(C)C)(C(C)C)ON1C(=O)C(CC2=CN(N=C21)CC3=CC=C(C=C3)OC(F)(F)F)NC(=O)O

DOS

IR

Vibrations