Geometry & MOs

Info

ID:	422443
PubChem CID:	135117838
Reduced:	SN2O3C20H26 (1)
Stoich.:	AB2C3D20E26 (1)
Weight, g/mol:	385.200156
ΔH_f, kcal/mol:	-93.06
Dipole, Da:	4.89
IP(EA), eV:	-8.76(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(1-morpholin-4-ylcyclohexyl)methylamino]-5-phenyl-1,2-oxazole-4-carboxylic acid

Drug info:

PubChemData

Smile

CN1CCC[C@]2([C@H]1CN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)CO

DOS

IR

Vibrations