Geometry & MOs

Info

ID:	399894
PubChem CID:	135043583
Reduced:	NSeC14H15 (1)
Stoich.:	ABC14D15 (1)
Weight, g/mol:	272.104859
ΔH_f, kcal/mol:	41.47
Dipole, Da:	3.96
IP(EA), eV:	-8.26(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-hydroxy-3-methoxy-5-methylphenyl)methyl benzoate

Drug info:

PubChemData

Smile

CCNC1=CC=C(C=C1)[Se]C2=CC=CC=C2

DOS

IR

Vibrations