Geometry & MOs

Info

ID:	138555
PubChem CID:	52384899
Reduced:	ON5C20H35 (1)
Stoich.:	AB5C20D35 (1)
Weight, g/mol:	377.12498
ΔH_f, kcal/mol:	-47.84
Dipole, Da:	4.67
IP(EA), eV:	-9.46(0.51)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

6-[[2-[(2-ethylphenyl)carbamoyl]phenyl]carbamoyl]-4-oxo-1H-pyrimidin-2-olate

Drug info:

PubChemData

Smile

CC(C)CC1=CN(N=N1)C[C@H]2CCCN(C2)C(=O)NC3CCCCCC3

DOS

IR

Vibrations