Geometry & MOs

Info

ID:	136286
PubChem CID:	52012628
Reduced:	SN2O2C18H20 (1)
Stoich.:	AB2C2D18E20 (1)
Weight, g/mol:	342.103814
ΔH_f, kcal/mol:	-25.71
Dipole, Da:	2.75
IP(EA), eV:	-8.41(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-5-ylmethyl)-4-propan-2-ylthieno[3,2-b]pyrrole-5-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations