Geometry & MOs

Info

ID:	188977
PubChem CID:	77796575
Reduced:	OC10H18 (3)
Stoich.:	AB10C18 (3)
Weight, g/mol:	340.105922
ΔH_f, kcal/mol:	-242.62
Dipole, Da:	2.93
IP(EA), eV:	-9.96(2.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-oxo-5-(2-phenylethenyl)-3,9-diazatricyclo[4.3.1.03,10]dec-4-ene-4,9-dicarboxylic acid

Drug info:

PubChemData

Smile

CC(C)CCCC(C)C1CCC2(C1CCC3C2(CCC4C3(C(C(CC4(C)C)O)(O)O)C)C)C

DOS

IR

Vibrations