Geometry & MOs

Info

ID:	130354
PubChem CID:	51075689
Reduced:	O2N5C14H19 (1)
Stoich.:	A2B5C14D19 (1)
Weight, g/mol:	347.130363
ΔH_f, kcal/mol:	-0.41
Dipole, Da:	4.2
IP(EA), eV:	-9.17(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-[4-[(2,6-dimethylmorpholin-4-yl)methyl]-1,3-thiazol-2-yl]-3-(furan-2-yl)prop-2-enamide

Drug info:

PubChemData

Smile

C1CN(CCN1CC2=CC=CO2)C(=O)CCN3C=NC=N3

DOS

IR

Vibrations