Geometry & MOs

Info

ID:	274620
PubChem CID:	103810684
Reduced:	FN2O2C14H19 (1)
Stoich.:	AB2C2D14E19 (1)
Weight, g/mol:	268.215078
ΔH_f, kcal/mol:	-116.79
Dipole, Da:	3.58
IP(EA), eV:	-8.85(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-aminocycloheptyl)-[3-(methoxymethyl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

COCC1CCCN(C1)C(=O)C2=CC(=C(C=C2)F)N

DOS

IR

Vibrations