Geometry & MOs

Info

ID:	136234
PubChem CID:	52004297
Reduced:	SN4O4C17H20 (1)
Stoich.:	AB4C4D17E20 (1)
Weight, g/mol:	359.110376
ΔH_f, kcal/mol:	-110.69
Dipole, Da:	9.03
IP(EA), eV:	-9.74(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(4-fluorophenyl)methyl-methylamino]-2-oxoethyl]-4-methylthieno[3,2-b]pyrrole-5-carboxamide

Drug info:

PubChemData

Smile

CN1C(=CC(=N1)C(=O)N[C@H]2CCS(=O)(=O)C2)NC(=O)CC3=CC=CC=C3

DOS

IR

Vibrations