Geometry & MOs

Info

ID:	422661
PubChem CID:	135118206
Reduced:	FO2N3C15H20 (1)
Stoich.:	AB2C3D15E20 (1)
Weight, g/mol:	379.189592
ΔH_f, kcal/mol:	-74.62
Dipole, Da:	5.46
IP(EA), eV:	-9.07(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-3-(2-methylspiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]-1'-carbonyl)-6,7-dihydro-5H-1-benzofuran-4-one

Drug info:

PubChemData

Smile

CN1C=NC=C1CN(CCO)CC2=CC(=C(C=C2)OC)F

DOS

IR

Vibrations