Geometry & MOs

Info

ID:	48344
PubChem CID:	10539061
Reduced:	O2N5H11C12 (1)
Stoich.:	A2B5C11D12 (1)
Weight, g/mol:	257.047027
ΔH_f, kcal/mol:	86.84
Dipole, Da:	7.48
IP(EA), eV:	-9.19(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(E)-dimethylsulfamoyliminomethyl]-3-nitrobenzene

Drug info:

PubChemData

Smile

CC1=CC(=NO1)N2C(=NN=N2)C3=CC=C(C=C3)OC

DOS

IR

Vibrations