Geometry & MOs

Info

ID:	352427
PubChem CID:	127283515
Reduced:	N2O2C17H24 (1)
Stoich.:	A2B2C17D24 (1)
Weight, g/mol:	266.199428
ΔH_f, kcal/mol:	-85.42
Dipole, Da:	8.65
IP(EA), eV:	-8.93(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]azepan-2-one

Drug info:

PubChemData

Smile

CC1CCCC(N1C(=O)C2=C(C3=C(N2)CCCC3=O)C)C

DOS

IR

Vibrations