Geometry & MOs

Info

ID:	136284
PubChem CID:	52012587
Reduced:	SN2O3C18H18 (1)
Stoich.:	AB2C3D18E18 (1)
Weight, g/mol:	316.104563
ΔH_f, kcal/mol:	-67.96
Dipole, Da:	4.86
IP(EA), eV:	-8.68(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-fluorophenyl)methyl]-4-propan-2-ylthieno[3,2-b]pyrrole-5-carboxamide

Drug info:

PubChemData

Smile

CC(C)N1C2=C(C=C1C(=O)NC3=CC=C(C=C3)C(=O)OC)SC=C2

DOS

IR

Vibrations