Geometry & MOs

Info

ID:	299083
PubChem CID:	117670628
Reduced:	N3O5C31H35 (1)
Stoich.:	A3B5C31D35 (1)
Weight, g/mol:	510.27701
ΔH_f, kcal/mol:	-206.09
Dipole, Da:	3.15
IP(EA), eV:	-8.75(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4,6,8-tris(4-hydroxyphenyl)decan-2-yl]phenol

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1C)C)CN2C(=O)N(C(=O)N(C2=O)CC3=CC(=C(C(=C3)C)O)C)CC4=CC(=C(C(=C4)C)O)C

DOS

IR

Vibrations