Geometry & MOs

Info

ID:	319401
PubChem CID:	126655867
Reduced:	NO2C24H25 (1)
Stoich.:	AB2C24D25 (1)
Weight, g/mol:	334.12388
ΔH_f, kcal/mol:	-32.16
Dipole, Da:	2.66
IP(EA), eV:	-8.78(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-tert-butyl-5-(2-methoxyphenyl)phenyl] methanesulfonate

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=CC(=C1)C2=CC=CC=C2OC)NC(=O)C3=CC=CC=C3

DOS

IR

Vibrations