Geometry & MOs

Info

ID:	68530
PubChem CID:	46508596
Reduced:	NS2O4C21H23 (1)
Stoich.:	AB2C4D21E23 (1)
Weight, g/mol:	392.122835
ΔH_f, kcal/mol:	-116.3
Dipole, Da:	6.08
IP(EA), eV:	-9.19(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1C)OC(=O)C=C2CN(CC3=CC=CS3)C4CCS(=O)(=O)C4

DOS

IR

Vibrations