Geometry & MOs

Info

ID:	243596
PubChem CID:	99233226
Reduced:	SN2O2C20H24 (1)
Stoich.:	AB2C2D20E24 (1)
Weight, g/mol:	377.123169
ΔH_f, kcal/mol:	-51.86
Dipole, Da:	1.43
IP(EA), eV:	-9.2(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[2-oxo-2-[(2S)-2-propan-2-ylpyrrolidin-1-yl]ethyl]-1,3-thiazol-2-yl]-2-thiophen-2-ylacetamide

Drug info:

PubChemData

Smile

CC(C)[C@H]1CCCN1C(=O)C2=CC=C(C=C2)CNC(=O)C3=CC=CS3

DOS

IR

Vibrations