Geometry & MOs

Info

ID:	132144
PubChem CID:	51313377
Reduced:	N3O4C19H25 (1)
Stoich.:	A3B4C19D25 (1)
Weight, g/mol:	372.130777
ΔH_f, kcal/mol:	-150.59
Dipole, Da:	2.36
IP(EA), eV:	-8.83(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-fluoro-3,4-dihydro-2H-thiochromen-4-yl)-3-[(2-phenylacetyl)amino]propanamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(NC(=O)NC1)CN2CCCC2C3=CC(=CC=C3)OC

DOS

IR

Vibrations