Geometry & MOs

Info

ID:	434687
PubChem CID:	135175482
Reduced:	NO4C20H33 (1)
Stoich.:	AB4C20D33 (1)
Weight, g/mol:	388.14905
ΔH_f, kcal/mol:	-172.53
Dipole, Da:	3.98
IP(EA), eV:	-8.63(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-[3-[3-(3-methyl-2-oxobutoxy)propoxy]propoxy]pyridin-2-yl]methanesulfinothioamide

Drug info:

PubChemData

Smile

C[C@H](C1=CC=C(C=C1)OCCCOCCCOCC(=O)C)NC(C)C

DOS

IR

Vibrations