Geometry & MOs

Info

ID:	29742
PubChem CID:	836843
Reduced:	N2O2Cl3H9C14 (1)
Stoich.:	A2B2C3D9E14 (1)
Weight, g/mol:	300.136159
ΔH_f, kcal/mol:	-59.12
Dipole, Da:	6.7
IP(EA), eV:	-9.24(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-tert-butyl-4-hydroxyphenyl) 4-methoxybenzoate

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1NC(=O)C2=C(C=C(C=C2)Cl)Cl)C(=O)N)Cl

DOS

IR

Vibrations