Geometry & MOs

Info

ID:	8872
PubChem CID:	82711
Reduced:	O2C11H14 (1)
Stoich.:	A2B11C14 (1)
Weight, g/mol:	178.09938
ΔH_f, kcal/mol:	-76.2
Dipole, Da:	3.08
IP(EA), eV:	-9.15(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-hydroxy-3-methyl-5-propan-2-ylbenzaldehyde

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1O)C(C)C)C=O

DOS

IR

Vibrations