Geometry & MOs

Info

ID:

299557

PubChem CID:

117687614

Reduced:

NO4C18H19 (2)

Stoich.:

AB4C18D19 (2)

Weight, g/mol:

711.279195

ΔHf, kcal/mol:

-194.13

Dipole, Da:

7.31

IP(EA), eV:

 -7.93(-0.47)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

6-methoxy-2-[3-methoxy-4-[4-[2-methoxy-5-[5-(3,4,5-trimethoxyphenyl)-1,2-oxazol-3-yl]phenoxy]butoxy]phenyl]-2,3-dihydro-1H-quinazolin-4-one

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)NC(NC2=O)C3=CC(=C(C=C3)OCCOC4=C(C=CC(=C4)/C=C/C5=CC(=C(C(=C5)OC)OC)OC)OC)OC

DOS

IR

Vibrations