Geometry & MOs

Info

ID:	82235
PubChem CID:	49855790
Reduced:	SO3N5C15H15 (1)
Stoich.:	AB3C5D15E15 (1)
Weight, g/mol:	350.220557
ΔH_f, kcal/mol:	8.95
Dipole, Da:	8.14
IP(EA), eV:	-9.23(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-1-[4-(5-propan-2-yloxypyridin-2-yl)oxycyclohexyl]oxypropan-2-yl]acetamide

Drug info:

PubChemData

Smile

C1[C@@H]2[C@@H](C2NC(=O)C3=CC=CS3)CN1C4=NC=C(C=N4)C(=O)NO

DOS

IR

Vibrations