Geometry & MOs

Info

ID:	33918
PubChem CID:	7888744
Reduced:	S2O3N5C18H19 (1)
Stoich.:	A2B3C5D18E19 (1)
Weight, g/mol:	384.114378
ΔH_f, kcal/mol:	-8.34
Dipole, Da:	5.67
IP(EA), eV:	-9.26(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[bis(prop-2-enyl)amino]-2-oxoethyl] 3-(thiophene-2-carbonylamino)benzoate

Drug info:

PubChemData

Smile

C1CN(CCN1C(=O)CSC2=NN=C3N2C=CC=C3)S(=O)(=O)C4=CC=CC=C4

DOS

IR

Vibrations