Geometry & MOs

Info

ID:	274410
PubChem CID:	103809109
Reduced:	SN3O3C12H25 (1)
Stoich.:	AB3C3D12E25 (1)
Weight, g/mol:	287.163377
ΔH_f, kcal/mol:	-160.62
Dipole, Da:	6.0
IP(EA), eV:	-9.07(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(2-propan-2-yl-1,3-benzoxazol-5-yl)piperidine-2-carboxamide

Drug info:

PubChemData

Smile

CS(=O)(=O)NCCCNC(=O)C1CCC(CC1)CN

DOS

IR

Vibrations