Geometry & MOs

Info

ID:	351903
PubChem CID:	127282821
Reduced:	SO2N3C10H15 (1)
Stoich.:	AB2C3D10E15 (1)
Weight, g/mol:	294.103814
ΔH_f, kcal/mol:	-37.64
Dipole, Da:	0.97
IP(EA), eV:	-8.96(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methylthiomorpholine-4-carboxamide

Drug info:

PubChemData

Smile

CC1CN(CCS1)C(=O)NC2=NOC(=C2)C

DOS

IR

Vibrations