Geometry & MOs

Info

ID:	390582
PubChem CID:	134999817
Reduced:	OH22C23 (1)
Stoich.:	AB22C23 (1)
Weight, g/mol:	375.121906
ΔH_f, kcal/mol:	31.9
Dipole, Da:	2.58
IP(EA), eV:	-8.89(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-2-benzamido-3-(6-methyl-4-oxo-2-phenyl-1H-pyrimidin-5-yl)prop-2-enoic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C=C/C[C@@H](C2=CC=CC=C2)[C@H](C3=CC=CC=C3)O

DOS

IR

Vibrations