Geometry & MOs

Info

ID:	65478
PubChem CID:	46371223
Reduced:	N2O5C18H28 (1)
Stoich.:	A2B5C18D28 (1)
Weight, g/mol:	425.173942
ΔH_f, kcal/mol:	-204.46
Dipole, Da:	4.28
IP(EA), eV:	-8.75(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(4-methoxyphenoxy)pyrimidin-2-yl]-N-(2-phenylethyl)benzamide

Drug info:

PubChemData

Smile

CCCCCNC(=O)CCNC(=O)C1=CC(=C(C(=C1)OC)OC)OC

DOS

IR

Vibrations