Geometry & MOs

Info

ID:	421370
PubChem CID:	135115883
Reduced:	ON2C9H12 (2)
Stoich.:	AB2C9D12 (2)
Weight, g/mol:	390.205576
ΔH_f, kcal/mol:	-74.31
Dipole, Da:	3.36
IP(EA), eV:	-9.43(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NC=C2CCC3(C2=N1)CCCN(C3)C(=O)CN4CCCC4=O

DOS

IR

Vibrations