Geometry & MOs

Info

ID:	240889
PubChem CID:	93618059
Reduced:	SN3O3C15H23 (1)
Stoich.:	AB3C3D15E23 (1)
Weight, g/mol:	271.168462
ΔH_f, kcal/mol:	-112.3
Dipole, Da:	4.92
IP(EA), eV:	-8.91(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyano-N-[2-[(3S)-3-methylpiperidin-1-yl]ethyl]benzamide

Drug info:

PubChemData

Smile

C[C@H]1CCCCN1CCNC(=O)C2=CC(=CC=C2)S(=O)(=O)N

DOS

IR

Vibrations