Geometry & MOs

Info

ID:	416318
PubChem CID:	135089331
Reduced:	N2O5C25H30 (1)
Stoich.:	A2B5C25D30 (1)
Weight, g/mol:	387.150429
ΔH_f, kcal/mol:	-163.89
Dipole, Da:	5.77
IP(EA), eV:	-8.32(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6,7-dimethoxyspiro[3,4-dihydroisochromene-1,4'-piperidine]-1'-yl)-2-thiophen-2-ylethanone

Drug info:

PubChemData

Smile

COC1=C(C=C2C(=C1)CCOC23CCN(CC3)C(=O)C4=C(N=C5CCCC5=C4)OC)OC

DOS

IR

Vibrations