Geometry & MOs

Info

ID:	224562
PubChem CID:	85344792
Reduced:	O3C13H20 (1)
Stoich.:	A3B13C20 (1)
Weight, g/mol:	227.069477
ΔH_f, kcal/mol:	-129.94
Dipole, Da:	2.68
IP(EA), eV:	-9.76(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-methylidene-2-oxopyrimidin-4-yl)benzamide

Drug info:

PubChemData

Smile

COC(=O)C12CCOC1C2C3CCCCC3

DOS

IR

Vibrations