Geometry & MOs

Info

ID:	53206
PubChem CID:	14709773
Reduced:	O4C21H22 (1)
Stoich.:	A4B21C22 (1)
Weight, g/mol:	382.141638
ΔH_f, kcal/mol:	-121.93
Dipole, Da:	1.4
IP(EA), eV:	-8.72(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3,4-diacetyloxy-1-[(2E)-4-methylpenta-2,4-dienyl]naphthalene-2-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C2=CC=CC=C2C(=C1OC(=O)C)OC(=O)C)C/C=C/C(=C)C

DOS

IR

Vibrations