Geometry & MOs

Info

ID:	407539
PubChem CID:	135080286
Reduced:	BO3C13H25 (1)
Stoich.:	AB3C13D25 (1)
Weight, g/mol:	136.088815
ΔH_f, kcal/mol:	-248.18
Dipole, Da:	5.11
IP(EA), eV:	-9.79(0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-5-(methoxymethylidene)bicyclo[2.2.1]hept-2-ene

Drug info:

PubChemData

Smile

B1(OC(C(O1)(C)C)(C)C)C(CC(=O)C)C(C)C

DOS

IR

Vibrations