Geometry & MOs

Info

ID:	417592
PubChem CID:	135102174
Reduced:	OF2N4C17H24 (1)
Stoich.:	AB2C4D17E24 (1)
Weight, g/mol:	357.195346
ΔH_f, kcal/mol:	-87.99
Dipole, Da:	3.16
IP(EA), eV:	-8.39(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1'-(6-methylpyrazin-2-yl)-2-phenylspiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]

Drug info:

PubChemData

Smile

CC1=C(N=CN1)CN(CCN(C)C)CC2=C(C=C(C=C2F)OC)F

DOS

IR

Vibrations