Geometry & MOs

Info

ID:	312585
PubChem CID:	126606564
Reduced:	OC22H30 (1)
Stoich.:	AB22C30 (1)
Weight, g/mol:	408.09501
ΔH_f, kcal/mol:	-64.44
Dipole, Da:	1.77
IP(EA), eV:	-8.46(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

iodo-(2,3,4,6-tetramethylphenyl)-(2,4,6-trimethylphenyl)methanol

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1C)C)C)C(C)(C2=C(C(=C(C(=C2)C)C)C)C)O

DOS

IR

Vibrations