Geometry & MOs

Info

ID:	157156
PubChem CID:	56422201
Reduced:	SN2O4C16H24 (1)
Stoich.:	AB2C4D16E24 (1)
Weight, g/mol:	420.161997
ΔH_f, kcal/mol:	-145.94
Dipole, Da:	2.95
IP(EA), eV:	-8.84(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-methylbenzoyl)-N-[(4-pyridin-4-yl-1,3-thiazol-2-yl)methyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1CC(CN(C1)S(=O)(=O)NCC2=C3C(=CC=C2)OCCO3)C

DOS

IR

Vibrations