Geometry & MOs

Info

ID:	233937
PubChem CID:	92252604
Reduced:	SN2O4C19H20 (1)
Stoich.:	AB2C4D19E20 (1)
Weight, g/mol:	359.166748
ΔH_f, kcal/mol:	-99.7
Dipole, Da:	2.86
IP(EA), eV:	-8.75(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-cyclopentyl-1-(4-methylthieno[3,2-b]pyrrole-5-carbonyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC[C@H](C(=O)NC1=CC(=CC=C1)OC)N2C(=CC3=C2SC=C3)C(=O)OC

DOS

IR

Vibrations