Geometry & MOs

Info

ID:	174273
PubChem CID:	75746948
Reduced:	ClSN3O5C19H24 (1)
Stoich.:	ABC3D5E19F24 (1)
Weight, g/mol:	506.05079
ΔH_f, kcal/mol:	-204.77
Dipole, Da:	7.48
IP(EA), eV:	-9.86(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

[6-[3-nitro-4-[2-[[3-(trifluoromethyl)phenyl]methylidene]hydrazinyl]phenyl]sulfonyliminocyclohexa-2,4-dien-1-ylidene]methanediolate

Drug info:

PubChemData

Smile

C1CCC2C(C1)C(=O)N(C2=O)CCC(=O)NCCNS(=O)(=O)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations