Geometry & MOs

Info

ID:	175051
PubChem CID:	75849948
Reduced:	NO5C21H35 (1)
Stoich.:	AB5C21D35 (1)
Weight, g/mol:	327.130443
ΔH_f, kcal/mol:	-222.87
Dipole, Da:	5.71
IP(EA), eV:	-8.1(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-ethoxyethoxy)-N-(6-fluoro-3,4-dihydro-2H-thiochromen-4-yl)propanamide

Drug info:

PubChemData

Smile

CCOCCOC(C)C(=O)NC(C1=CC(=C(C=C1)OCC)OCC)C(C)C

DOS

IR

Vibrations