Geometry & MOs

Info

ID:	339461
PubChem CID:	127261394
Reduced:	O2C13H20 (1)
Stoich.:	A2B13C20 (1)
Weight, g/mol:	274.120509
ΔH_f, kcal/mol:	-96.79
Dipole, Da:	1.83
IP(EA), eV:	-9.19(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethenyl 2-(5,8-dimethoxy-3,4-dihydronaphthalen-2-yl)acetate

Drug info:

PubChemData

Smile

CC1=C(C(CCC1)(C)C)CC(=O)OC=C

DOS

IR

Vibrations