Geometry & MOs

Info

ID:	421590
PubChem CID:	135116274
Reduced:	N4O7C30H34 (1)
Stoich.:	A4B7C30D34 (1)
Weight, g/mol:	356.173607
ΔH_f, kcal/mol:	-4.93
Dipole, Da:	7.3
IP(EA), eV:	-5.23(-3.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,4-dimethyl-1,3-oxazol-5-yl)-(6-methoxyspiro[3,4-dihydroisochromene-1,4'-piperidine]-1'-yl)methanone

Drug info:

PubChemData

Smile

COC1=C(C=C2C3C4=CC=C(C=C4)OCCOCCN(CC(=O)N3CCC2=C1)C(=O)CCC5=NNC(=O)C=C5)OC

DOS

IR

Vibrations