Geometry & MOs

Info

ID:	57280
PubChem CID:	22395583
Reduced:	O3H18C20 (1)
Stoich.:	A3B18C20 (1)
Weight, g/mol:	276.099774
ΔH_f, kcal/mol:	-44.84
Dipole, Da:	4.22
IP(EA), eV:	-9.45(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6,6-dihydroxy-4-methoxycyclohexa-2,4-dien-1-yl)-(4-methoxyphenyl)methanone

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC2(C=CC=CC2C(=O)C3=CC=CC=C3)O

DOS

IR

Vibrations