Geometry & MOs

Info

ID:	65288
PubChem CID:	29211907
Reduced:	OSN7C27H29 (1)
Stoich.:	ABC7D27E29 (1)
Weight, g/mol:	405.208613
ΔH_f, kcal/mol:	110.64
Dipole, Da:	8.83
IP(EA), eV:	-7.74(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(tert-butylsulfamoyl)-N-[(Z)-[(1R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanylidene]amino]benzamide

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)NC(=O)CSC2=NNC(=N2)NN=C(CC3=CC=CC=C3)CC4=CC=CC=C4

DOS

IR

Vibrations