Geometry & MOs

Info

ID:	387652
PubChem CID:	134986309
Reduced:	BrSN2O4C10H11 (1)
Stoich.:	ABC2D4E10F11 (1)
Weight, g/mol:	254.035924
ΔH_f, kcal/mol:	-94.18
Dipole, Da:	6.85
IP(EA), eV:	-9.43(-1.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-chloro-4-cyanoimino-3-methylnaphthalen-1-ylidene)cyanamide

Drug info:

PubChemData

Smile

COC\1=CC(=NC(=O)CBr)C=C/C1=N/S(=O)(=O)C

DOS

IR

Vibrations