Geometry & MOs

Info

ID:	362589
PubChem CID:	127308346
Reduced:	OSN4C20H22 (1)
Stoich.:	ABC4D20E22 (1)
Weight, g/mol:	393.081698
ΔH_f, kcal/mol:	39.4
Dipole, Da:	1.26
IP(EA), eV:	-8.89(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(6-methylsulfanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(1,3-thiazol-2-yl)morpholine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CN(N=C1)C2CCCN(C2)C(=O)NC3=CC=CC(=C3)C4=CC=CS4

DOS

IR

Vibrations