Geometry & MOs

Info

ID:	384509
PubChem CID:	134977126
Reduced:	O2C15H16 (1)
Stoich.:	A2B15C16 (1)
Weight, g/mol:	412.219101
ΔH_f, kcal/mol:	-8.24
Dipole, Da:	2.45
IP(EA), eV:	-9.59(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(=C)C(C=C=C(C)C=O)(C1=CC=CC=C1)O

DOS

IR

Vibrations