Geometry & MOs

Info

ID:	142360
PubChem CID:	53021269
Reduced:	O2N3C22H23 (1)
Stoich.:	A2B3C22D23 (1)
Weight, g/mol:	459.159434
ΔH_f, kcal/mol:	-6.87
Dipole, Da:	2.66
IP(EA), eV:	-9.54(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2,5-dimethoxyphenyl)methyl]-3-[6-(3-fluorophenyl)pyrimidin-4-yl]oxybenzamide

Drug info:

PubChemData

Smile

CC(C)CCNC(=O)C1=CC=CC(=C1)C2=CC(=NC=N2)OC3=CC=CC=C3

DOS

IR

Vibrations