Geometry & MOs

Info

ID:	353381
PubChem CID:	127284757
Reduced:	SO3N5C18H23 (1)
Stoich.:	AB3C5D18E23 (1)
Weight, g/mol:	322.135114
ΔH_f, kcal/mol:	-50.69
Dipole, Da:	3.98
IP(EA), eV:	-8.76(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-cyclopropyl-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1C2=NNC(=O)C=C2)C(=O)N(CC3CCCO3)C4CCSC4

DOS

IR

Vibrations