Geometry & MOs

Info

ID:	126769
PubChem CID:	50977691
Reduced:	N3O3C19H23 (1)
Stoich.:	A3B3C19D23 (1)
Weight, g/mol:	350.075885
ΔH_f, kcal/mol:	-54.43
Dipole, Da:	4.08
IP(EA), eV:	-8.32(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-[2-(1,3-thiazol-2-yl)ethyl]propanamide

Drug info:

PubChemData

Smile

CCCCC(=O)NC1=C(C=C(C=C1)NC(=O)C2=C(ON=C2)C3CC3)C

DOS

IR

Vibrations