Geometry & MOs

Info

ID:	396423
PubChem CID:	135028397
Reduced:	N2O2C13H16 (1)
Stoich.:	A2B2C13D16 (1)
Weight, g/mol:	394.141638
ΔH_f, kcal/mol:	-28.08
Dipole, Da:	1.33
IP(EA), eV:	-9.33(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-hydroxy-4,5-dimethoxyphenyl)-(4-methoxy-3-phenylmethoxyphenyl)methanone

Drug info:

PubChemData

Smile

CCCCO/C(=C(/C1=CC=CC=C1C)\[N+]#N)/[O-]

DOS

IR

Vibrations