Geometry & MOs

Info

ID:	183924
PubChem CID:	77090389
Reduced:	S2N3O4C15H19 (1)
Stoich.:	A2B3C4D15E19 (1)
Weight, g/mol:	311.130363
ΔH_f, kcal/mol:	-123.61
Dipole, Da:	8.01
IP(EA), eV:	-9.11(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1,1-dioxothiolan-3-yl)methyl]-2-[methyl(pyridin-4-ylmethyl)amino]acetamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)CCNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N)OC)C

DOS

IR

Vibrations