Geometry & MOs

Info

ID:	233771
PubChem CID:	92093453
Reduced:	ClN2O2H13C17 (1)
Stoich.:	AB2C2D13E17 (1)
Weight, g/mol:	403.156577
ΔH_f, kcal/mol:	0.16
Dipole, Da:	5.52
IP(EA), eV:	-9.07(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(6-methoxypyrazin-2-yl)oxycyclohexyl]-2-(4-methylphenyl)ethenesulfonamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Cl)C(=O)NCC2=CN=C(C=C2)C3=CC=CO3

DOS

IR

Vibrations