Geometry & MOs

Info

ID:	387939
PubChem CID:	134987474
Reduced:	C7H10 (2)
Stoich.:	A7B10 (2)
Weight, g/mol:	212.08373
ΔH_f, kcal/mol:	1.12
Dipole, Da:	0.95
IP(EA), eV:	-9.13(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-benzylidenehepta-2,5-diyne-1,7-diol

Drug info:

PubChemData

Smile

CCC(C)/C(=C/CC1=CC=CC=C1)/C

DOS

IR

Vibrations