Geometry & MOs

Info

ID:	191454
PubChem CID:	78148263
Reduced:	NOH9C10 (2)
Stoich.:	ABC9D10 (2)
Weight, g/mol:	570.319268
ΔH_f, kcal/mol:	-8.6
Dipole, Da:	6.88
IP(EA), eV:	-9.04(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 8-[5-(2-methoxy-2-oxoethylidene)-12-methyl-9-oxo-10,21,22-trioxatricyclo[15.3.1.13,7]docos-13-en-11-yl]-3-methylocta-3,5,7-trienoate

Drug info:

PubChemData

Smile

CC(=O)NC1=CC2=CC=CC=C2C(=O)N(C3=CC=CC=C31)CC=C

DOS

IR

Vibrations