Geometry & MOs

Info

ID:	293966
PubChem CID:	117420348
Reduced:	O3C16H26 (1)
Stoich.:	A3B16C26 (1)
Weight, g/mol:	266.167065
ΔH_f, kcal/mol:	-137.22
Dipole, Da:	3.43
IP(EA), eV:	-8.65(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-phenyl-4-propan-2-ylphenyl)butanal

Drug info:

PubChemData

Smile

CC(C)(C)C1=C(C(=CC(=C1)OC)C(C)(C)CO)OC

DOS

IR

Vibrations