Geometry & MOs

Info

ID:	68737
PubChem CID:	46509009
Reduced:	NO7C25H29 (1)
Stoich.:	AB7C25D29 (1)
Weight, g/mol:	400.109293
ΔH_f, kcal/mol:	-262.8
Dipole, Da:	5.28
IP(EA), eV:	-8.21(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-cyanophenyl)methyl 4-(oxolan-2-ylmethylsulfamoyl)benzoate

Drug info:

PubChemData

Smile

CC(C)OC(=O)COC(=O)C1CCC(=O)N(C1C2=CC=CC=C2OC)C3=CC=C(C=C3)OC

DOS

IR

Vibrations