Geometry & MOs

Info

ID:	414786
PubChem CID:	135087749
Reduced:	N2O2C10H11 (2)
Stoich.:	A2B2C10D11 (2)
Weight, g/mol:	386.166414
ΔH_f, kcal/mol:	-45.84
Dipole, Da:	4.1
IP(EA), eV:	-9.77(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-methoxyspiro[3,4-dihydroisochromene-1,4'-piperidine]-1'-yl)-(2-propyl-1,3-thiazol-4-yl)methanone

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C[C@@H]2CN(C[C@@H]2O)C(=O)C3=C4C(=NOC4=NC5=C3CCC5)C

DOS

IR

Vibrations