Geometry & MOs

Info

ID:	64634
PubChem CID:	29203627
Reduced:	N2O6C23H28 (1)
Stoich.:	A2B6C23D28 (1)
Weight, g/mol:	434.114772
ΔH_f, kcal/mol:	-201.05
Dipole, Da:	9.72
IP(EA), eV:	-8.51(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methoxy-N-(3-morpholin-4-ylsulfonylphenyl)-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Drug info:

PubChemData

Smile

CCOC1=C(C=CC(=C1)/C=C/C(=O)OCC(=O)NC(=O)C2=CC=CN2C)OCC(C)C

DOS

IR

Vibrations