Geometry & MOs

Info

ID:	163381
PubChem CID:	57903686
Reduced:	O3C35H38 (1)
Stoich.:	A3B35C38 (1)
Weight, g/mol:	538.235539
ΔH_f, kcal/mol:	-77.48
Dipole, Da:	1.07
IP(EA), eV:	-8.9(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[2-(4-methoxycarbonyloxyphenyl)propan-2-yl]phenyl] [4-[2-(3-methylphenyl)propan-2-yl]phenyl] carbonate

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(C)(C)C2=CC(=C(C=C2)OC(=O)OC3=CC=C(C=C3)C(C)(C)C4=CC(=C(C=C4)C)C)C

DOS

IR

Vibrations