Geometry & MOs

Info

ID:	371399
PubChem CID:	127346248
Reduced:	O2N3C14H21 (1)
Stoich.:	A2B3C14D21 (1)
Weight, g/mol:	386.162391
ΔH_f, kcal/mol:	-63.57
Dipole, Da:	7.73
IP(EA), eV:	-9.31(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(2,6-dimethylmorpholin-4-yl)sulfonylpiperazin-1-yl]-(5-ethyl-1,3-oxazol-4-yl)methanone

Drug info:

PubChemData

Smile

CN1C2=C(C=N1)C(CCC2)NC(=O)CC3CCOC3

DOS

IR

Vibrations