Geometry & MOs

Info

ID:	339100
PubChem CID:	127260357
Reduced:	O3C21H26 (1)
Stoich.:	A3B21C26 (1)
Weight, g/mol:	254.094294
ΔH_f, kcal/mol:	-108.94
Dipole, Da:	2.8
IP(EA), eV:	-8.84(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-ethenyl-2-hydroxyphenyl)methyl benzoate

Drug info:

PubChemData

Smile

CC(C)(C)CC(C)(C)C1=C(C(=CC=C1)OC(=O)C2=CC=CC=C2)O

DOS

IR

Vibrations