Geometry & MOs

Info

ID:	136287
PubChem CID:	52012629
Reduced:	SN2O3C18H18 (1)
Stoich.:	AB2C3D18E18 (1)
Weight, g/mol:	388.124549
ΔH_f, kcal/mol:	-48.08
Dipole, Da:	2.5
IP(EA), eV:	-8.41(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-acetylphenyl)-4-(2-phenylethyl)thieno[3,2-b]pyrrole-5-carboxamide

Drug info:

PubChemData

Smile

CC(C)N1C2=C(C=C1C(=O)NCC3=CC4=C(C=C3)OCO4)SC=C2

DOS

IR

Vibrations