Geometry & MOs

Info

ID:	349551
PubChem CID:	127275438
Reduced:	SN3O3C20H23 (1)
Stoich.:	AB3C3D20E23 (1)
Weight, g/mol:	318.157957
ΔH_f, kcal/mol:	-80.45
Dipole, Da:	3.11
IP(EA), eV:	-8.32(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,3-dihydro-1,4-benzodioxin-5-yl)pyrrolidin-1-yl]-morpholin-4-ylmethanone

Drug info:

PubChemData

Smile

C1CCC2=C(C1)N=C(S2)NC(=O)N3CCCC3C4=C5C(=CC=C4)OCCO5

DOS

IR

Vibrations