Geometry & MOs

Info

ID:	312292
PubChem CID:	126604152
Reduced:	NO4H15C16 (1)
Stoich.:	AB4C15D16 (1)
Weight, g/mol:	460.24023
ΔH_f, kcal/mol:	-83.47
Dipole, Da:	12.86
IP(EA), eV:	-9.08(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[bis(4-propan-2-ylphenoxy)methyl]phenanthrene

Drug info:

PubChemData

Smile

CCCN(CC#C)C1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)O

DOS

IR

Vibrations