Geometry & MOs

Info

ID:	257378
PubChem CID:	103145627
Reduced:	SN2O4C8H10 (1)
Stoich.:	AB2C4D8E10 (1)
Weight, g/mol:	310.073576
ΔH_f, kcal/mol:	-73.11
Dipole, Da:	3.3
IP(EA), eV:	-10.15(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-dimethyl-4-nitrophenyl)-2-methyl-1H-imidazole-5-sulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1S(=O)(=O)N)C)[N+](=O)[O-]

DOS

IR

Vibrations