Geometry & MOs

Info

ID:	324435
PubChem CID:	126677669
Reduced:	N3S3O7C27H45 (1)
Stoich.:	A3B3C7D27E45 (1)
Weight, g/mol:	201.100108
ΔH_f, kcal/mol:	-332.88
Dipole, Da:	6.87
IP(EA), eV:	-8.4(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (3R)-3-hydroxy-2-oxopyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CCC(C)[C@@H]1[C@H](CC(=O)O[C@@H](CC(=O)N[C@@H](C(=O)N[C@@H](C(=O)N1)CSSCCC=C)CCSC)C)OCCC=O

DOS

IR

Vibrations