Geometry & MOs

Info

ID:	199623
PubChem CID:	79271996
Reduced:	ON2C11H18 (1)
Stoich.:	AB2C11D18 (1)
Weight, g/mol:	285.184112
ΔH_f, kcal/mol:	11.19
Dipole, Da:	4.64
IP(EA), eV:	-9.29(0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-benzylpiperidin-3-yl)-2-(prop-2-ynylamino)acetamide

Drug info:

PubChemData

Smile

CC(CC1CC1)NC(=O)CNCC#C

DOS

IR

Vibrations