Geometry & MOs

Info

ID:	347461
PubChem CID:	127272310
Reduced:	SO2N3C21H27 (1)
Stoich.:	AB2C3D21E27 (1)
Weight, g/mol:	309.151098
ΔH_f, kcal/mol:	-44.81
Dipole, Da:	3.2
IP(EA), eV:	-9.24(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(oxan-2-ylmethyl)-4-(1,3-thiazol-2-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC(C(OC1)C2=CC=CC=C2)CNC(=O)N3CCC(CC3)C4=NC=CS4

DOS

IR

Vibrations