Geometry & MOs

Info

ID:	55899
PubChem CID:	17397229
Reduced:	SN2O2H14C16 (1)
Stoich.:	AB2C2D14E16 (1)
Weight, g/mol:	328.070405
ΔH_f, kcal/mol:	-40.45
Dipole, Da:	4.42
IP(EA), eV:	-8.92(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethylphenyl)-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)SCC(=O)N3

DOS

IR

Vibrations