Geometry & MOs

Info

ID:	217296
PubChem CID:	85087575
Reduced:	O6C19H26 (1)
Stoich.:	A6B19C26 (1)
Weight, g/mol:	350.172939
ΔH_f, kcal/mol:	-235.05
Dipole, Da:	2.24
IP(EA), eV:	-9.42(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-acetyloxy-6-methoxy-5-methyl-7-phenylmethoxyhept-3-enoate

Drug info:

PubChemData

Smile

CC(C(COCC1=CC=CC=C1)OC)C(C=CC(=O)OC)OC(=O)C

DOS

IR

Vibrations