Geometry & MOs

Info

ID:	422849
PubChem CID:	135118510
Reduced:	ClN2O2C15H19 (1)
Stoich.:	AB2C2D15E19 (1)
Weight, g/mol:	370.24811
ΔH_f, kcal/mol:	-81.57
Dipole, Da:	3.7
IP(EA), eV:	-9.45(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-1'-[[5-(2-methylpropyl)-1,2,4-oxadiazol-3-yl]methyl]spiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]-2-amine

Drug info:

PubChemData

Smile

C1C[C@H]([C@]2(C1)CCCN(C2)C(=O)C3=NC=C(C=C3)Cl)O

DOS

IR

Vibrations