Geometry & MOs

Info

ID:	11588
PubChem CID:	118037
Reduced:	ON2C17H26 (1)
Stoich.:	AB2C17D26 (1)
Weight, g/mol:	274.204513
ΔH_f, kcal/mol:	-28.94
Dipole, Da:	2.07
IP(EA), eV:	-8.66(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[ethoxy(phenyl)methyl]-5,5-diethyl-4,6-dihydro-1H-pyrimidine

Drug info:

PubChemData

Smile

CCC1(CNC(=NC1)C(C2=CC=CC=C2)OCC)CC

DOS

IR

Vibrations