Geometry & MOs

Info

ID:	149266
PubChem CID:	53788938
Reduced:	O3C39H76 (1)
Stoich.:	A3B39C76 (1)
Weight, g/mol:	350.150467
ΔH_f, kcal/mol:	-207.32
Dipole, Da:	9.37
IP(EA), eV:	-6.86(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2-(methoxymethyl)-6-[(4-methoxyphenyl)methyl]-3H-pyrazolo[1,5-c]quinazolin-6-ium-5-one

Drug info:

PubChemData

Smile

CCCCCCCCCCC=CCCCCCCCCOC(=O)OCCCCCCCCCCCCCCCC(C)C

DOS

IR

Vibrations