Geometry & MOs

Info

ID:	418440
PubChem CID:	135104784
Reduced:	O3N5C21H25 (1)
Stoich.:	A3B5C21D25 (1)
Weight, g/mol:	390.180424
ΔH_f, kcal/mol:	-68.01
Dipole, Da:	4.67
IP(EA), eV:	-8.95(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(2-phenylspiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]-1'-yl)methyl]-1,2,4-oxadiazole-3-carboxamide

Drug info:

PubChemData

Smile

CN1CCC[C@]2([C@H]1CN(CC2)C(=O)C3=CN=C(N=C3)NC4=CC=CC=C4)C(=O)O

DOS

IR

Vibrations