Geometry & MOs

Info

ID:	23233
PubChem CID:	602895
Reduced:	NOSH17C19 (1)
Stoich.:	ABCD17E19 (1)
Weight, g/mol:	307.103085
ΔH_f, kcal/mol:	38.93
Dipole, Da:	4.57
IP(EA), eV:	-8.21(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-phenylanilino)-1-thiophen-2-ylpropan-1-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)NCCC(=O)C3=CC=CS3

DOS

IR

Vibrations