Geometry & MOs

Info

ID:	402799
PubChem CID:	135057309
Reduced:	NO2C18H25 (1)
Stoich.:	AB2C18D25 (1)
Weight, g/mol:	299.152144
ΔH_f, kcal/mol:	-87.41
Dipole, Da:	3.45
IP(EA), eV:	-8.7(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

pentyl 5-methoxy-2-pyridin-2-ylbenzoate

Drug info:

PubChemData

Smile

CCCCCCC(C)OC(=O)C1=CN(C2=CC=CC=C21)C

DOS

IR

Vibrations