Geometry & MOs

Info

ID:	126446
PubChem CID:	50965084
Reduced:	N2O5C22H24 (1)
Stoich.:	A2B5C22D24 (1)
Weight, g/mol:	316.124549
ΔH_f, kcal/mol:	-157.09
Dipole, Da:	4.06
IP(EA), eV:	-8.87(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S,4R,6S)-2-benzyl-6-(1,3-thiazol-2-yl)oxan-4-yl]acetamide

Drug info:

PubChemData

Smile

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=CC=C4NCC(=O)O

DOS

IR

Vibrations