Geometry & MOs

Info

ID:	362081
PubChem CID:	127305758
Reduced:	O2N3C23H29 (1)
Stoich.:	A2B3C23D29 (1)
Weight, g/mol:	394.167477
ΔH_f, kcal/mol:	-77.43
Dipole, Da:	7.23
IP(EA), eV:	-8.51(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-[3-(pyrrolidine-1-carbonyl)piperidin-1-yl]ethyl]sulfanylacetamide

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C3=C(N2)C=CC(=C3)C(=O)N4CCCC(C4)C(=O)N5CCCC5

DOS

IR

Vibrations