Geometry & MOs

Info

ID:	413922
PubChem CID:	135086873
Reduced:	ON2H20C25 (1)
Stoich.:	AB2C20D25 (1)
Weight, g/mol:	360.044775
ΔH_f, kcal/mol:	92.8
Dipole, Da:	1.95
IP(EA), eV:	-8.39(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NZ)-N-(5-chloro-3-diazo-1-methylindol-2-ylidene)-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CCN1C2=CC=CC=C2C(=C1C(=O)NC3=CC=CC=C3)C#CC4=CC=CC=C4

DOS

IR

Vibrations