Geometry & MOs

Info

ID:	182812
PubChem CID:	76940074
Reduced:	ClNSO2C11H14 (1)
Stoich.:	ABCD2E11F14 (1)
Weight, g/mol:	235.120843
ΔH_f, kcal/mol:	-59.49
Dipole, Da:	3.04
IP(EA), eV:	-9.28(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-hydroxyphenyl)-N-(2-hydroxypropyl)-N-methylprop-2-enamide

Drug info:

PubChemData

Smile

CC(CN(C)C(=O)C=CC1=CC=C(S1)Cl)O

DOS

IR

Vibrations