Geometry & MOs

Info

ID:	298967
PubChem CID:	117664566
Reduced:	O4C23H26 (1)
Stoich.:	A4B23C26 (1)
Weight, g/mol:	285.100108
ΔH_f, kcal/mol:	-126.04
Dipole, Da:	4.96
IP(EA), eV:	-9.07(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-hydroxy-4-methoxy-6-[(E)-2-pyridin-2-ylethenyl]benzoate

Drug info:

PubChemData

Smile

CC(=C)CCC1=C(C=C(C(=C1O)C(=O)OC)/C=C/CC2=CC=CC=C2)OC

DOS

IR

Vibrations