Geometry & MOs

Info

ID:	136289
PubChem CID:	52013113
Reduced:	OSN2C27H28 (1)
Stoich.:	ABC2D27E28 (1)
Weight, g/mol:	381.151098
ΔH_f, kcal/mol:	36.12
Dipole, Da:	2.82
IP(EA), eV:	-8.4(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(2-phenylethyl)thieno[3,2-b]pyrrole-5-carbonyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=CC4=C(N3CCC5=CC=CC=C5)C=CS4

DOS

IR

Vibrations