Geometry & MOs

Info

ID:	233829
PubChem CID:	92098518
Reduced:	N4O4C23H26 (1)
Stoich.:	A4B4C23D26 (1)
Weight, g/mol:	339.133139
ΔH_f, kcal/mol:	-87.09
Dipole, Da:	6.33
IP(EA), eV:	-8.72(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(3-cyanopyrazin-2-yl)oxycyclohexyl]-6-oxo-1H-pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1(CC2=C(O1)C(=CC=C2)OCC(=O)NC3CCC(CC3)OC4=NC=CN=C4C#N)C

DOS

IR

Vibrations