Geometry & MOs

Info

ID:	352390
PubChem CID:	127283477
Reduced:	ClOSN4C19H19 (1)
Stoich.:	ABCD4E19F19 (1)
Weight, g/mol:	385.146013
ΔH_f, kcal/mol:	38.92
Dipole, Da:	3.25
IP(EA), eV:	-9.34(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[2-(1,3-thiazol-2-yl)piperidine-1-carbonyl]phenyl]oxolane-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1C2=CC(=CC=C2)Cl)C(=O)N3CCCCC3C4=NC=CS4

DOS

IR

Vibrations