Geometry & MOs

Info

ID:	156580
PubChem CID:	56371226
Reduced:	N3O4C25H31 (1)
Stoich.:	A3B4C25D31 (1)
Weight, g/mol:	411.172896
ΔH_f, kcal/mol:	-141.52
Dipole, Da:	3.4
IP(EA), eV:	-7.98(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-imidazo[2,1-b][1,3]thiazol-6-ylacetyl)amino]-N-(3-pyrrolidin-1-ylphenyl)butanamide

Drug info:

PubChemData

Smile

CCC(=O)C1=CC=C(C=C1)OCC(=O)NC(C)CC(=O)NC2=CC(=CC=C2)N3CCCC3

DOS

IR

Vibrations