Geometry & MOs

Info

ID:	33906
PubChem CID:	7888669
Reduced:	OSN3C17H17 (1)
Stoich.:	ABC3D17E17 (1)
Weight, g/mol:	374.093643
ΔH_f, kcal/mol:	39.56
Dipole, Da:	2.46
IP(EA), eV:	-8.62(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-morpholin-4-yl-2-oxoethyl) 3-(thiophene-2-carbonylamino)benzoate

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)C(=O)CSC2=NN=C3N2C=CC=C3)C

DOS

IR

Vibrations