Geometry & MOs

Info

ID:	58874
PubChem CID:	24715011
Reduced:	SO2N3C18H27 (1)
Stoich.:	AB2C3D18E27 (1)
Weight, g/mol:	274.113984
ΔH_f, kcal/mol:	-93.1
Dipole, Da:	3.98
IP(EA), eV:	-8.55(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[6-(2-methylprop-2-enyl)thieno[2,3-b]pyrrol-5-yl]-pyrrolidin-1-ylmethanone

Drug info:

PubChemData

Smile

CCCN(CC1=NC2=C(C3=C(S2)CC(CC3)C)C(=O)N1)CC(C)O

DOS

IR

Vibrations