Geometry & MOs

Info

ID:	168271
PubChem CID:	74942813
Reduced:	N4O5C22H28 (1)
Stoich.:	A4B5C22D28 (1)
Weight, g/mol:	656.19525
ΔH_f, kcal/mol:	-191.22
Dipole, Da:	4.03
IP(EA), eV:	-8.99(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-6,8-bis[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-2,3-dihydrochromen-4-one

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC=CN(C1=O)CC(=O)NC2CCCC3=CC=CC=C23)NC.C(=O)O

DOS

IR

Vibrations