Geometry & MOs

Info

ID:	416431
PubChem CID:	135089444
Reduced:	O2N3C13H19 (1)
Stoich.:	A2B3C13D19 (1)
Weight, g/mol:	317.156184
ΔH_f, kcal/mol:	-69.32
Dipole, Da:	3.86
IP(EA), eV:	-9.28(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1'-[(1-ethylpyrazol-3-yl)methyl]spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]

Drug info:

PubChemData

Smile

CC1=NC(=NC=C1C(=O)C)NCC2CCCOC2

DOS

IR

Vibrations