Geometry & MOs

Info

ID:	61582
PubChem CID:	26710693
Reduced:	N2O3H20C21 (1)
Stoich.:	A2B3C20D21 (1)
Weight, g/mol:	427.102434
ΔH_f, kcal/mol:	-44.65
Dipole, Da:	5.13
IP(EA), eV:	-8.51(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-1-(2-methoxyphenyl)-N-[[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]methyl]-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

C1COC2=C(O1)C=CC(=C2)/C=C/C(=O)NCCC3=CNC4=CC=CC=C43

DOS

IR

Vibrations