Geometry & MOs

Info

ID:	256164
PubChem CID:	103137481
Reduced:	FN2H17C18 (1)
Stoich.:	AB2C17D18 (1)
Weight, g/mol:	255.183444
ΔH_f, kcal/mol:	23.14
Dipole, Da:	1.52
IP(EA), eV:	-9.21(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[1-[(5-methyloxolan-2-yl)methyl]piperidin-2-yl]acetate

Drug info:

PubChemData

Smile

CNC(CC1=CC(=CC=C1)F)C2=CC=CC3=C2C=NC=C3

DOS

IR

Vibrations