Geometry & MOs

Info

ID:	233825
PubChem CID:	92098514
Reduced:	SO2N4C18H24 (1)
Stoich.:	AB2C4D18E24 (1)
Weight, g/mol:	329.148789
ΔH_f, kcal/mol:	-38.08
Dipole, Da:	6.74
IP(EA), eV:	-8.83(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(3-cyanopyrazin-2-yl)oxycyclohexyl]-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)SCC(=O)NC2CCC(CC2)OC3=NC=CN=C3C#N

DOS

IR

Vibrations