Geometry & MOs

Info

ID:	302182
PubChem CID:	124360319
Reduced:	FN3O5C19H24 (1)
Stoich.:	AB3C5D19E24 (1)
Weight, g/mol:	393.169999
ΔH_f, kcal/mol:	-263.27
Dipole, Da:	10.37
IP(EA), eV:	-8.84(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[[(2R)-2-[[(3R)-1-(4-fluorophenyl)-5-oxopyrrolidine-3-carbonyl]amino]-3-methylbutanoyl]amino]propanoic acid

Drug info:

PubChemData

Smile

C[C@@H](C(=O)O)NC(=O)[C@@H](C(C)C)NC(=O)[C@H]1CC(=O)N(C1)C2=CC=C(C=C2)F

DOS

IR

Vibrations