Geometry & MOs

Info

ID:	342754
PubChem CID:	127265917
Reduced:	ClO2N4C15H23 (1)
Stoich.:	AB2C4D15E23 (1)
Weight, g/mol:	328.124549
ΔH_f, kcal/mol:	-92.2
Dipole, Da:	3.51
IP(EA), eV:	-9.25(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-methyl-1,2-thiazol-4-yl)-(3-phenyl-3,3a,4,6,7,7a-hexahydro-2H-pyrano[4,3-b]pyrrol-1-yl)methanone

Drug info:

PubChemData

Smile

CCN(CC)C(=O)NC1CCN(CC1)C(=O)C2=CC(=CN2)Cl

DOS

IR

Vibrations