Geometry & MOs

Info

ID:	171509
PubChem CID:	75384470
Reduced:	OSN3C17H21 (1)
Stoich.:	ABC3D17E21 (1)
Weight, g/mol:	329.065654
ΔH_f, kcal/mol:	4.42
Dipole, Da:	6.11
IP(EA), eV:	-9.25(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[(2-phenyl-1,3-thiazol-5-yl)methylamino]methyl]thiophene-3-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)C(C2=CC=CC=N2)NCC3=CC(=CS3)C(=O)N

DOS

IR

Vibrations