Geometry & MOs

Info

ID:	280484
PubChem CID:	103849535
Reduced:	NO4C14H19 (1)
Stoich.:	AB4C14D19 (1)
Weight, g/mol:	295.097521
ΔH_f, kcal/mol:	-158.29
Dipole, Da:	4.15
IP(EA), eV:	-9.02(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(3-chloro-4-methylphenyl)-N-[(3-hydroxyoxolan-3-yl)methyl]prop-2-enamide

Drug info:

PubChemData

Smile

C1COCC1(CNC(=O)CCOC2=CC=CC=C2)O

DOS

IR

Vibrations