Geometry & MOs

Info

ID:	149925
PubChem CID:	53789607
Reduced:	OF4N4H14C17 (1)
Stoich.:	AB4C4D14E17 (1)
Weight, g/mol:	443.184506
ΔH_f, kcal/mol:	-151.21
Dipole, Da:	4.6
IP(EA), eV:	-8.77(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[6-[[(4-methoxyphenyl)-diphenylmethyl]amino]-2-oxo-4,5-dihydropyrimidin-3-yl]acetic acid

Drug info:

PubChemData

Smile

C1C=C(N=C(N1C2=CC(=CC=C2)OC(C(F)F)(F)F)N)C3=CN=CC=C3

DOS

IR

Vibrations