Geometry & MOs

Info

ID:	359464
PubChem CID:	127298738
Reduced:	SN2O2C20H20 (1)
Stoich.:	AB2C2D20E20 (1)
Weight, g/mol:	352.124549
ΔH_f, kcal/mol:	-29.21
Dipole, Da:	3.84
IP(EA), eV:	-8.71(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-hydroxynaphthalen-2-yl)-[2-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=CSC(=N1)C2CCCCN2C(=O)C3=C(C4=CC=CC=C4C=C3)O

DOS

IR

Vibrations