Geometry & MOs

Info

ID:	342602
PubChem CID:	127265762
Reduced:	N2O3C20H20 (1)
Stoich.:	A2B3C20D20 (1)
Weight, g/mol:	275.152144
ΔH_f, kcal/mol:	-72.44
Dipole, Da:	0.4
IP(EA), eV:	-8.63(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-hydroxyphenyl)-N-[1-(oxolan-2-yl)propan-2-yl]prop-2-enamide

Drug info:

PubChemData

Smile

CC(C(=O)N1CCC2=CC=CC=C21)NC(=O)C=CC3=CC(=CC=C3)O

DOS

IR

Vibrations