Geometry & MOs

Info

ID:	334883
PubChem CID:	127253689
Reduced:	NO5H23C27 (1)
Stoich.:	AB5C23D27 (1)
Weight, g/mol:	401.137556
ΔH_f, kcal/mol:	-98.79
Dipole, Da:	3.61
IP(EA), eV:	-8.32(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dimethoxy-6-(2-pyrazol-1-ylethyl)indeno[1,2-c]isoquinoline-5,11-dione

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CCN2C3=C(C4=C(C2=O)C(=C(C=C4)OC)OC)C(=O)C5=CC=CC=C53

DOS

IR

Vibrations