Geometry & MOs

Info

ID:	413038
PubChem CID:	135085982
Reduced:	OH16C18 (1)
Stoich.:	AB16C18 (1)
Weight, g/mol:	215.094629
ΔH_f, kcal/mol:	53.97
Dipole, Da:	1.97
IP(EA), eV:	-9.39(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(=C)C#CC(C1=CC=CC=C1)(C2=CC=CC=C2)O

DOS

IR

Vibrations