Geometry & MOs

Info

ID:	89886
PubChem CID:	49965196
Reduced:	N3O6C21H23 (1)
Stoich.:	A3B6C21D23 (1)
Weight, g/mol:	424.17467
ΔH_f, kcal/mol:	-132.78
Dipole, Da:	6.7
IP(EA), eV:	-8.57(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2,2-dimethoxyethyl)-3-(3,4-dimethoxyphenyl)-4-pyridin-3-yl-1,4-dihydropyrrolo[3,4-c]pyrazol-6-one

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)OC)C2C3=C(NN=C3C(=O)N2CC(OC)OC)C4=CC=CO4

DOS

IR

Vibrations