Geometry & MOs

Info

ID:	68531
PubChem CID:	46508597
Reduced:	N2S2O3C19H24 (1)
Stoich.:	A2B2C3D19E24 (1)
Weight, g/mol:	406.138485
ΔH_f, kcal/mol:	-83.12
Dipole, Da:	7.86
IP(EA), eV:	-9.38(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1,1-dioxothiolan-3-yl)-(thiophen-2-ylmethyl)amino]-N-(3-phenylpropyl)acetamide

Drug info:

PubChemData

Smile

C1CS(=O)(=O)CC1N(CC2=CC=CS2)CC(=O)NCCC3=CC=CC=C3

DOS

IR

Vibrations