Geometry & MOs

Info

ID:	166228
PubChem CID:	74653417
Reduced:	O6H20C21 (1)
Stoich.:	A6B20C21 (1)
Weight, g/mol:	383.100502
ΔH_f, kcal/mol:	-162.94
Dipole, Da:	2.69
IP(EA), eV:	-9.06(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[3-methoxy-4-[3-(2-nitrophenyl)prop-2-enoyloxy]phenyl]prop-2-enoate

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)C=CC(=O)OC2=C(C=C(C=C2)C=CC(=O)OC)OC

DOS

IR

Vibrations