Geometry & MOs

Info

ID:	57683
PubChem CID:	22432688
Reduced:	S2N3O7H17C18 (1)
Stoich.:	A2B3C7D17E18 (1)
Weight, g/mol:	274.113984
ΔH_f, kcal/mol:	-232.75
Dipole, Da:	6.23
IP(EA), eV:	-9.07(-1.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-phenyl-1,3-thiazol-2-yl)-N-propylpropanamide

Drug info:

PubChemData

Smile

CC1=CSC2=NC(=C(C(=O)N12)S(=O)(=O)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC)C

DOS

IR

Vibrations