Geometry & MOs

Info

ID:	421035
PubChem CID:	135115264
Reduced:	NO5C22H25 (1)
Stoich.:	AB5C22D25 (1)
Weight, g/mol:	367.237211
ΔH_f, kcal/mol:	-185.36
Dipole, Da:	6.01
IP(EA), eV:	-9.0(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-ethyl-5-propan-2-ylpyrazol-3-yl)-(2-methylspiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]-1'-yl)methanone

Drug info:

PubChemData

Smile

C1CN(C[C@H]([C@@]1(CC2=CC=CC=C2)C(=O)O)O)C(=O)CCC3=CC=C(C=C3)O

DOS

IR

Vibrations