Geometry & MOs

Info

ID:	136317
PubChem CID:	52018850
Reduced:	OSF2N2H14C20 (1)
Stoich.:	ABC2D2E14F20 (1)
Weight, g/mol:	384.04994
ΔH_f, kcal/mol:	-34.61
Dipole, Da:	2.25
IP(EA), eV:	-8.66(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)NC(=O)C2=CC3=C(N2CC4=CC(=CC=C4)F)C=CS3)F

DOS

IR

Vibrations