Geometry & MOs

Info

ID:	366385
PubChem CID:	127319866
Reduced:	ON3C10H13 (2)
Stoich.:	AB3C10D13 (2)
Weight, g/mol:	325.109627
ΔH_f, kcal/mol:	-27.53
Dipole, Da:	7.15
IP(EA), eV:	-9.19(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(oxolane-3-carbonylamino)-1,3-thiazol-4-yl]methyl]oxolane-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(CC(C1)C(=O)N2CCN3C=CN=C3C2)C(=O)N4CCN5C=CN=C5C4

DOS

IR

Vibrations