Geometry & MOs

Info

ID:	126596
PubChem CID:	50969275
Reduced:	N4O4C17H22 (1)
Stoich.:	A4B4C17D22 (1)
Weight, g/mol:	310.135114
ΔH_f, kcal/mol:	-138.35
Dipole, Da:	2.61
IP(EA), eV:	-9.21(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S,4S)-1-methyl-4-(4-thiophen-2-ylbutanoylamino)pyrrolidine-2-carboxylate

Drug info:

PubChemData

Smile

C1CN(CCN1CC2=CC=CC=C2CO)C(=O)CN3C(=O)CNC3=O

DOS

IR

Vibrations