Geometry & MOs

Info

ID:	412410
PubChem CID:	135085301
Reduced:	BO2C18H21 (1)
Stoich.:	AB2C18D21 (1)
Weight, g/mol:	303.056529
ΔH_f, kcal/mol:	-117.75
Dipole, Da:	4.02
IP(EA), eV:	-9.12(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NE)-N-(1,3-benzodioxol-4-ylmethylidene)-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

[B-]12(C3=CC=CC=C3C([OH+]1)(C)C)C4=CC=CC=C4C(O2)(C)C

DOS

IR

Vibrations