Geometry & MOs

Info

ID:	170558
PubChem CID:	75252574
Reduced:	O2C11H22 (1)
Stoich.:	A2B11C22 (1)
Weight, g/mol:	471.215806
ΔH_f, kcal/mol:	-124.76
Dipole, Da:	3.16
IP(EA), eV:	-9.86(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-12,12-dimethyl-21-phenylmethoxy-10,19,21-triazahexacyclo[13.5.2.01,13.03,11.04,9.015,19]docosa-4,6,8,10-tetraene-20,22-dione

Drug info:

PubChemData

Smile

CC(C)C(CC=CC(C(C)C)O)O

DOS

IR

Vibrations