Geometry & MOs

Info

ID:	345393
PubChem CID:	127269693
Reduced:	SN2O4C20H22 (1)
Stoich.:	AB2C4D20E22 (1)
Weight, g/mol:	388.091535
ΔH_f, kcal/mol:	-116.47
Dipole, Da:	1.34
IP(EA), eV:	-8.52(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-phenylsulfanyl-2,3-dihydro-1,4-benzodioxin-7-yl)thiomorpholine-4-carboxamide

Drug info:

PubChemData

Smile

CC1CN(CCO1)C(=O)NC2=CC3=C(C=C2SC4=CC=CC=C4)OCCO3

DOS

IR

Vibrations