Geometry & MOs

Info

ID:	414280
PubChem CID:	135087236
Reduced:	OF2N4C17H22 (1)
Stoich.:	AB2C4D17E22 (1)
Weight, g/mol:	349.15143
ΔH_f, kcal/mol:	-92.13
Dipole, Da:	4.08
IP(EA), eV:	-9.04(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1'-[5-(trifluoromethyl)pyridin-2-yl]spiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]-2-amine

Drug info:

PubChemData

Smile

CN(C)CCN(CC1=CN=CN1)C(=O)CCC2=C(C=C(C=C2)F)F

DOS

IR

Vibrations