Geometry & MOs

Info

ID:	339736
PubChem CID:	127261738
Reduced:	S2N3O6C7H9 (1)
Stoich.:	A2B3C6D7E9 (1)
Weight, g/mol:	399.06557
ΔH_f, kcal/mol:	-118.18
Dipole, Da:	4.73
IP(EA), eV:	-9.98(-2.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(4E)-4-[5-(4-chlorophenyl)sulfonylfuran-2-yl]imino-2-methylbutan-2-yl] N-aminocarbamate

Drug info:

PubChemData

Smile

CCOC(=O)NNS(=O)(=O)C1=CC=C(S1)[N+](=O)[O-]

DOS

IR

Vibrations