Geometry & MOs

Info

ID:	217268
PubChem CID:	85087536
Reduced:	O6C19H24 (1)
Stoich.:	A6B19C24 (1)
Weight, g/mol:	348.136159
ΔH_f, kcal/mol:	-239.42
Dipole, Da:	1.73
IP(EA), eV:	-9.47(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-naphthalen-2-yl-1-(2,4,6-trimethoxyphenyl)prop-2-en-1-one

Drug info:

PubChemData

Smile

CC1(OC2C(C3C(C(=O)C2O1)OC(O3)(C)C)OCC4=CC=CC=C4)C

DOS

IR

Vibrations