Geometry & MOs

Info

ID:	199137
PubChem CID:	79203429
Reduced:	NO3C12H19 (1)
Stoich.:	AB3C12D19 (1)
Weight, g/mol:	328.091535
ΔH_f, kcal/mol:	-126.57
Dipole, Da:	2.24
IP(EA), eV:	-9.43(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(oxan-4-ylmethylsulfamoyl)phenyl]ethanethioamide

Drug info:

PubChemData

Smile

CCN(CC1=CC=CO1)C(=O)CCC(C)O

DOS

IR

Vibrations