Geometry & MOs

Info

ID:	420546
PubChem CID:	135113773
Reduced:	N2O2C21H32 (1)
Stoich.:	A2B2C21D32 (1)
Weight, g/mol:	398.177647
ΔH_f, kcal/mol:	-91.05
Dipole, Da:	2.46
IP(EA), eV:	-9.02(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pyrazin-2-yl-(4-spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]-1'-ylpiperidin-1-yl)methanone

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN(C)CC(=O)N2CCC[C@@]3(C2)CCC[C@H]3OC

DOS

IR

Vibrations