Geometry & MOs

Info

ID:	329994
PubChem CID:	127246981
Reduced:	O2N5C16H19 (1)
Stoich.:	A2B5C16D19 (1)
Weight, g/mol:	355.200825
ΔH_f, kcal/mol:	-22.44
Dipole, Da:	5.13
IP(EA), eV:	-8.86(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-cyclohexyl-1,2-oxazol-5-yl)-[2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CNC1=NC(=CN=C1)C2CCCN2C(=O)C3=CN(C(=O)C=C3)C

DOS

IR

Vibrations