Geometry & MOs

Info

ID:	240890
PubChem CID:	93618065
Reduced:	ON3C16H21 (1)
Stoich.:	AB3C16D21 (1)
Weight, g/mol:	329.185175
ΔH_f, kcal/mol:	-1.27
Dipole, Da:	6.13
IP(EA), eV:	-9.04(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide

Drug info:

PubChemData

Smile

C[C@H]1CCCN(C1)CCNC(=O)C2=CC=C(C=C2)C#N

DOS

IR

Vibrations