Geometry & MOs

Info

ID:	151483
PubChem CID:	53812508
Reduced:	O4H18C23 (1)
Stoich.:	A4B18C23 (1)
Weight, g/mol:	208.121178
ΔH_f, kcal/mol:	-70.12
Dipole, Da:	1.17
IP(EA), eV:	-8.75(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[6-(dimethylamino)pyridin-3-yl]-4-hydroxybutan-2-one

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C=C2C(OC3=C(C2=O)C=CC(=C3)O)C4=CC=CC=C4

DOS

IR

Vibrations