Geometry & MOs

Info

ID:	312170
PubChem CID:	126603446
Reduced:	SO3N4H12C13 (1)
Stoich.:	AB3C4D12E13 (1)
Weight, g/mol:	204.129634
ΔH_f, kcal/mol:	-24.24
Dipole, Da:	2.77
IP(EA), eV:	-8.94(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[5-(sulfanylamino)hexan-2-yl]acetamide

Drug info:

PubChemData

Smile

CC1=NN(C2=C1NC(=NC2=O)C3=CC(=CC=C3)S(=O)O)C

DOS

IR

Vibrations