Geometry & MOs

Info

ID:	131822
PubChem CID:	51264816
Reduced:	SO2N3C17H23 (1)
Stoich.:	AB2C3D17E23 (1)
Weight, g/mol:	343.156577
ΔH_f, kcal/mol:	-88.46
Dipole, Da:	4.29
IP(EA), eV:	-8.59(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butan-2-yl-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCC(C)NC(=O)CCN1C=NC2=C(C1=O)C3=C(S2)CCCC3

DOS

IR

Vibrations