Geometry & MOs

Info

ID:	405369
PubChem CID:	135073696
Reduced:	O8C19H24 (1)
Stoich.:	A8B19C24 (1)
Weight, g/mol:	442.162768
ΔH_f, kcal/mol:	-320.62
Dipole, Da:	3.03
IP(EA), eV:	-9.12(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 2-[(4-hydroxyphenyl)methyl]-2-[(E)-4-methoxycarbonyloxy-4-phenylbut-2-enyl]propanedioate

Drug info:

PubChemData

Smile

CC(/C=C/CC(CC1=CC=C(C=C1)O)(C(=O)OC)C(=O)OC)OC(=O)OC

DOS

IR

Vibrations