Geometry & MOs

Info

ID:	389818
PubChem CID:	134995383
Reduced:	NO4C10H17 (1)
Stoich.:	AB4C10D17 (1)
Weight, g/mol:	248.141244
ΔH_f, kcal/mol:	-176.52
Dipole, Da:	1.84
IP(EA), eV:	-10.09(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-acetyl-4-methylidene-5-propan-2-ylidenecyclohept-2-ene-1-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C=NC(C)(C)COC(=O)C

DOS

IR

Vibrations