Geometry & MOs

Info

ID:	231708
PubChem CID:	87574488
Reduced:	OH18C19 (1)
Stoich.:	AB18C19 (1)
Weight, g/mol:	491.298147
ΔH_f, kcal/mol:	67.55
Dipole, Da:	2.57
IP(EA), eV:	-8.78(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C=CC1(CO1)C=C.C1C2=CC=CC=C2C3=CC=CC=C31

DOS

IR

Vibrations