Geometry & MOs

Info

ID:	84245
PubChem CID:	49865098
Reduced:	SN4O6C22H22 (1)
Stoich.:	AB4C6D22E22 (1)
Weight, g/mol:	442.094705
ΔH_f, kcal/mol:	-10.49
Dipole, Da:	3.89
IP(EA), eV:	-9.48(-1.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(dibenzylamino)-3,5-dinitrobenzenesulfonamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CCN(CCC2=CC=CC=C2)C3=C(C=C(C=C3[N+](=O)[O-])S(=O)(=O)N)[N+](=O)[O-]

DOS

IR

Vibrations