Geometry & MOs

Info

ID:	55385
PubChem CID:	17395318
Reduced:	SO2N3C18H23 (1)
Stoich.:	AB2C3D18E23 (1)
Weight, g/mol:	275.163377
ΔH_f, kcal/mol:	-22.73
Dipole, Da:	2.53
IP(EA), eV:	-8.62(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,6-dimethylphenyl)-2-[methyl(prop-2-enylcarbamoyl)amino]acetamide

Drug info:

PubChemData

Smile

C1CN(CCN1C2=CC=CC=C2)C(=O)NCCSCC3=CC=CO3

DOS

IR

Vibrations