Geometry & MOs

Info

ID:	419075
PubChem CID:	135107437
Reduced:	ON4C19H26 (1)
Stoich.:	AB4C19D26 (1)
Weight, g/mol:	357.168856
ΔH_f, kcal/mol:	2.08
Dipole, Da:	7.97
IP(EA), eV:	-8.72(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(C)C(=O)NCC2=CC=CC=C2N3C=CN=C3

DOS

IR

Vibrations