Geometry & MOs

Info

ID:	278907
PubChem CID:	103839769
Reduced:	ClSN2O2C13H19 (1)
Stoich.:	ABC2D2E13F19 (1)
Weight, g/mol:	330.090183
ΔH_f, kcal/mol:	-62.75
Dipole, Da:	3.79
IP(EA), eV:	-9.04(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(2,3-dichlorophenyl)-N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]prop-2-enamide

Drug info:

PubChemData

Smile

CC(CNC(=O)/C=C/C1=CC=C(S1)Cl)(CN(C)C)O

DOS

IR

Vibrations