Geometry & MOs

Info

ID:	186134
PubChem CID:	77395641
Reduced:	NOC18H29 (1)
Stoich.:	ABC18D29 (1)
Weight, g/mol:	410.136553
ΔH_f, kcal/mol:	-69.58
Dipole, Da:	4.1
IP(EA), eV:	-8.79(0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-O-[1-[3-(4-methoxyphenyl)prop-2-enoyloxy]ethyl] 4-O-phenyl 2-methylidenebutanedioate

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C(=CC1CCCC2C1=C(CC2)C)C

DOS

IR

Vibrations