Geometry & MOs

Info

ID:	233822
PubChem CID:	92098511
Reduced:	O2N5H21C22 (1)
Stoich.:	A2B5C21D22 (1)
Weight, g/mol:	375.169525
ΔH_f, kcal/mol:	37.34
Dipole, Da:	4.78
IP(EA), eV:	-9.05(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(3-cyanopyrazin-2-yl)oxycyclohexyl]-2-indol-1-ylacetamide

Drug info:

PubChemData

Smile

C1CC(CCC1NC(=O)C2=CC=C(C=C2)N3C=CC=C3)OC4=NC=CN=C4C#N

DOS

IR

Vibrations