Geometry & MOs

Info

ID:	233851
PubChem CID:	92098540
Reduced:	O4N6C23H24 (1)
Stoich.:	A4B6C23D24 (1)
Weight, g/mol:	389.185175
ΔH_f, kcal/mol:	-26.86
Dipole, Da:	9.87
IP(EA), eV:	-8.4(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(3-cyanopyrazin-2-yl)oxycyclohexyl]-2-(1-methylindol-3-yl)acetamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)OC)C2=NNC(=C2)C(=O)NC3CCC(CC3)OC4=NC=CN=C4C#N

DOS

IR

Vibrations