Geometry & MOs

Info

ID:	419773
PubChem CID:	135109046
Reduced:	NO2C24H29 (1)
Stoich.:	AB2C24D29 (1)
Weight, g/mol:	271.204848
ΔH_f, kcal/mol:	-57.93
Dipole, Da:	3.26
IP(EA), eV:	-9.3(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1'-(cyclobutylmethyl)-2-methylspiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]

Drug info:

PubChemData

Smile

CO[C@@H]1CCC[C@]12CCCN(C2)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations