Geometry & MOs

Info

ID:	171801
PubChem CID:	75428181
Reduced:	NSO2C14H23 (1)
Stoich.:	ABC2D14E23 (1)
Weight, g/mol:	326.11227
ΔH_f, kcal/mol:	-81.48
Dipole, Da:	2.01
IP(EA), eV:	-9.02(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-methylthiophen-2-yl)methyl-propan-2-ylamino]-N-(2-oxothiolan-3-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C(C)NCCOCC2CCCO2

DOS

IR

Vibrations