Geometry & MOs

Info

ID:	399850
PubChem CID:	135043130
Reduced:	OC18H24 (1)
Stoich.:	AB18C24 (1)
Weight, g/mol:	235.120843
ΔH_f, kcal/mol:	-31.38
Dipole, Da:	2.02
IP(EA), eV:	-8.99(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-acetyl-N,N-diethyl-3-hydroxybenzamide

Drug info:

PubChemData

Smile

CCCCCC/C=C/[C@@H]1C=CC2=CC=CC=C2[C@@H]1O

DOS

IR

Vibrations