Geometry & MOs

Info

ID:	419660
PubChem CID:	135108675
Reduced:	O2N5C23H23 (1)
Stoich.:	A2B5C23D23 (1)
Weight, g/mol:	420.216141
ΔH_f, kcal/mol:	40.95
Dipole, Da:	3.39
IP(EA), eV:	-9.04(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(dimethylamino)spiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]-1'-yl]-(6-methoxy-3-methyl-1-benzofuran-2-yl)methanone

Drug info:

PubChemData

Smile

CN1C=NC=C1CN(CCO)C(=O)C2=CC(=NN2C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations