Geometry & MOs

Info

ID:	306066
PubChem CID:	125001517
Reduced:	SO2N4C16H18 (1)
Stoich.:	AB2C4D16E18 (1)
Weight, g/mol:	497.190376
ΔH_f, kcal/mol:	23.23
Dipole, Da:	2.02
IP(EA), eV:	-8.0(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-2-[(3S)-3-[(4-chloro-3-methylphenoxy)methyl]-1-(1,3-thiazol-2-ylmethyl)piperidin-3-yl]-N-methylacetamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)C(=O)N2CCCC[C@H]2C3=C4N(C=CS4)C(=N3)C

DOS

IR

Vibrations