Geometry & MOs

Info

ID:	65016
PubChem CID:	29204336
Reduced:	SCl3N3O4H14C15 (1)
Stoich.:	AB3C3D4E14F15 (1)
Weight, g/mol:	413.013446
ΔH_f, kcal/mol:	-81.67
Dipole, Da:	4.11
IP(EA), eV:	-9.41(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethylsulfonyl-N'-(2,4,6-trichlorophenyl)piperidine-4-carbohydrazide

Drug info:

PubChemData

Smile

CN(OC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NNC2=C(C=C(C=C2Cl)Cl)Cl

DOS

IR

Vibrations