Geometry & MOs

Info

ID:	270416
PubChem CID:	103636477
Reduced:	ClNO2C13H18 (1)
Stoich.:	ABC2D13E18 (1)
Weight, g/mol:	279.163457
ΔH_f, kcal/mol:	-77.9
Dipole, Da:	3.58
IP(EA), eV:	-9.46(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-ethyl-4-methylpiperidin-1-yl)-(2-fluoro-4-methoxyphenyl)methanone

Drug info:

PubChemData

Smile

CCC1(CCN(CC1)C(=O)C2=CC=C(O2)Cl)C

DOS

IR

Vibrations