Geometry & MOs

Info

ID:	57172
PubChem CID:	22395427
Reduced:	C4H7 (6)
Stoich.:	A4B7 (6)
Weight, g/mol:	466.235539
ΔH_f, kcal/mol:	-63.1
Dipole, Da:	0.14
IP(EA), eV:	-8.66(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[4-[2-[4-hydroxy-2,6-bis(hydroxymethyl)phenyl]propan-2-yl]phenyl]propan-2-yl]-3,5-bis(hydroxymethyl)phenol

Drug info:

PubChemData

Smile

CC(C)(C)C(C1=CC=C(C=C1)C(C(C)(C)C)C(C)(C)C)C(C)(C)C

DOS

IR

Vibrations