Geometry & MOs

Info

ID:	233837
PubChem CID:	92098526
Reduced:	SO3N5H19C20 (1)
Stoich.:	AB3C5D19E20 (1)
Weight, g/mol:	353.148789
ΔH_f, kcal/mol:	-2.64
Dipole, Da:	5.56
IP(EA), eV:	-9.2(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(3-cyanopyrazin-2-yl)oxycyclohexyl]-1-methyl-2-oxopyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(CCC1NC(=O)CSC2=NC3=CC=CC=C3O2)OC4=NC=CN=C4C#N

DOS

IR

Vibrations