Geometry & MOs

Info

ID:	324851
PubChem CID:	126678474
Reduced:	N2O5C22H30 (1)
Stoich.:	A2B5C22D30 (1)
Weight, g/mol:	318.157957
ΔH_f, kcal/mol:	-221.85
Dipole, Da:	7.8
IP(EA), eV:	-9.68(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-[(2S)-2-benzamido-3-methylbutanoyl]pyrrolidine-2-carboxylic acid

Drug info:

PubChemData

Smile

C1CCC(CC1)[C@@H](C(=O)N2CCCC[C@H]2C(=O)O)NC(=O)OCC3=CC=CC=C3

DOS

IR

Vibrations