Geometry & MOs

Info

ID:	216424
PubChem CID:	85086219
Reduced:	NO2C17H17 (1)
Stoich.:	AB2C17D17 (1)
Weight, g/mol:	267.183444
ΔH_f, kcal/mol:	-41.69
Dipole, Da:	3.96
IP(EA), eV:	-9.02(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-hydroxy-1-methoxy-3-methylpent-1-en-2-yl)-2-propyl-2,3-dihydropyridin-4-one

Drug info:

PubChemData

Smile

CC1CC(C2=CC=CC=C2N1C(=O)C3=CC=CC=C3)O

DOS

IR

Vibrations